Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride
TL;DR: Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride (CAS 80039-73-2) is a chemical compound with molecular formula C11H11ClN2O2 and molecular weight 238.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one;hydrochloride
Also Known As: Vasicinone hydrochloride, 2,3-Dihydro-3-hydroxypyrrolo(2,1-b)quinazolin-9(1H)-one hydrochloride, Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride, 3-hydroxy-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one hydrochloride, 3-Hydroxy-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one--hydrogen chloride (1/1)
| Molecular Formula | C11H11ClN2O2 |
|---|---|
| Molecular Weight | 238.05 g/mol |
| LogP | 1.2554 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 238.0509 |
| Heavy Atoms | 16 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 80039-73-2 |
|---|---|
| SMILES | C1CN2C(=NC3=CC=CC=C3C2=O)C1O.Cl |
| InChIKey | OTGHVLOXEXHAKU-UHFFFAOYSA-N |
Product Overview
Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride (CAS 80039-73-2), with molecular formula C11H11ClN2O2 and molecular weight 238.05 g/mol. IUPAC: 3-hydroxy-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one;hydrochloride.
Chemical Property Profile of Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride
Property Insights of Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride
The XLogP value of 1.2554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride. With a topological polar surface area (TPSA) of 52.9 Ų, Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride?
The CAS number of Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride is 80039-73-2.
What is the molecular formula of Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride?
The molecular formula of Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride is C11H11ClN2O2.
What is the molecular weight of Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride?
The molecular weight of Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride is 238.05 g/mol.
Where can I buy Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride?
You can request a quote for Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolo(2,1-b)quinazolin-9(1H)-one, 2,3-dihydro-3-hydroxy-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.