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1006717-55-0 molecular structure
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2-[4-(furan-2-carbonyl)(2H8)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine

ChemBase ID: 176874
Molecular Formular: C19H21N5O4
Molecular Mass: 383.40114
Monoisotopic Mass: 383.15935418
SMILES and InChIs

SMILES:
c1c(c(cc2c1nc(nc2N)N1CCN(CC1)C(=O)c1ccco1)OC)OC
Canonical SMILES:
COc1cc2nc(nc(c2cc1OC)N)N1CCN(CC1)C(=O)c1ccco1
InChI:
InChI=1S/C19H21N5O4/c1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h3-4,9-11H,5-8H2,1-2H3,(H2,20,21,22)
InChIKey:
IENZQIKPVFGBNW-UHFFFAOYSA-N

Cite this record

CBID:176874 http://www.chembase.cn/molecule-176874.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-[4-(furan-2-carbonyl)(2H8)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine
IUPAC Traditional name
2-[4-(furan-2-carbonyl)(2H8)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine
Synonyms
4-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl-d8]-2-furanylmethanone
1-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-4-(2-furanylcarbonxyl)piperazine-d8
Adversuten-d8
Adverszuten-d8
Alpress LP-d8
Furazosin-d8
Lentopres-d8
NSC 292810-d8
Peripress-d8
Prazosin-d8
CAS Number
1006717-55-0
PubChem SID
164232784
PubChem CID
25216777

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
TRC P702327 external link Add to cart
PubChem 25216777 external link
Data Source Data ID Price
TRC
P702327 external link Add to cart Please log in.
Data Source Data ID
PubChem 25216777 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.14705259  LogD (pH = 7.4) 1.4251277 
Log P 1.6505165  Molar Refractivity 104.4981 cm3
Polarizability 39.320755 Å3 Polar Surface Area 106.95 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
Chloroform expand Show data source
Apperance
Pale Brown Solid expand Show data source
Melting Point
257-268°C (dec.) expand Show data source
Storage Condition
-20°C Freezer, Under Inert Atmosphere expand Show data source
MSDS Link
Download expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

TRC TRC
Toronto Research Chemicals - P702327 external link
Labelled Prazosin. An antihypertensive. α1-Adrenergic blocker.

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
  • • Jaillon, P., et al.: Clin. Pharmacokinet., 5, 365 (1980)
  • • Russell, I.J., et al.: J. Rheumatol., 12, 94 (1980)
  • • Kostek, L.J.: Anal. Profiles Drug Subs., 18, 351 (1980)
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PATENTS

PATENTS

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INTERNET

INTERNET

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