Poly-N(5)-(3-hydroxypropylglutamine)-prazosin carbamate

HCID 3083323

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Basic information

CAS: 140486-68-6
Standard SMILES: COc1cc2nc(N3CCN(C(=O)c4ccco4)CC3)nc(NC(=O)OCCCN[C@@H](CCC(N)=O)C(=O)O)c2cc1OC
InChIKey: OIUSYCOEKIPOMN-SFHVURJKSA-N
Molecular formula: C28H35N7O9
Average molar mass: 613.6 g/mol
Monoisotopic mass: 613.24962572

Overview

structure given in first source

Names & identifiers

Preferred name: Poly-N(5)-(3-hydroxypropylglutamine)-prazosin carbamate
IUPAC: (2S)-5-amino-2-[3-[[2-[4-(furan-2-carbonyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-yl]carbamoyloxy]propylamino]-5-oxopentanoic acid
English name: poly-N(5)-(3-hydroxypropylglutamine)-prazosin carbamate
Molecular formula: C28H35N7O9
Molecular weight: 613.619

Names & synonyms

140486-68-6DTXSID30161411DTXCID1083902p(HPG-prazosin carbamate)PHPG-prazosin carbamateRefChem:175126(2S)-5-amino-2-[3-[[2-[4-(furan-2-carbonyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-yl]carbamoyloxy]propylamino]-5-oxopentanoic acidN~2~-{3-[({2-[4-(Furan-2-carbonyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-yl}carbamoyl)oxy]propyl}-L-glutaminepoly-N(5)-(3-hydroxypropylglutamine)-prazosin carbamate

Database identifiers

CAS: 140486-68-6
PubChem CID: 3083323
DTXSID: DTXSID30161411

Properties

Computed structural properties

XLogP: -1.2
Topological polar surface area: 212 Å²
Hydrogen bond donors: 4
Hydrogen bond acceptors: 13
Rotatable bonds: 15
Heavy atoms: 44
Formal charge: 0
Complexity: 983

Chemistry & industry

Suppliers2 total

HONEST JOY HOLDINGS LIMITED[email protected]

CHEMICAL LAND21[email protected]

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