BAS 10198351
TL;DR: BAS 10198351 (CAS 850187-97-2) is a chemical compound with molecular formula C16H14ClN3O2 and molecular weight 315.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-chloro-2-hydroxypropyl)-3-methyl-1-oxopyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: BAS 10198351, UPCMLD0ENAT5750368:001, 5-(3-chloro-2-hydroxypropyl)-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile, 5-(3-chloro-2-hydroxy-propyl)-3-methyl-1-oxo-pyrido[1,2-a]benzimidazole-4-carbonitrile, 5-(3-chloro-2-hydroxypropyl)-3-methyl-1-oxopyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C16H14ClN3O2 |
|---|---|
| Molecular Weight | 315.08 g/mol |
| LogP | 2.034 |
| Topological Polar Surface Area | 70.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.07745 |
| Heavy Atoms | 22 |
| Complexity | 965.31665 |
Chemical Identifiers
| CAS Number | 850187-97-2 |
|---|---|
| SMILES | CC1=CC(=O)N2C3=CC=CC=C3N(C2=C1C#N)CC(CCl)O |
Product Overview
BAS 10198351 (CAS 850187-97-2), with molecular formula C16H14ClN3O2 and molecular weight 315.08 g/mol. IUPAC: 5-(3-chloro-2-hydroxypropyl)-3-methyl-1-oxopyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of BAS 10198351
Property Insights of BAS 10198351
The XLogP value of 2.034 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 10198351. The TPSA of 70.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10198351. Following Lipinski's Rule of Five, BAS 10198351 has 1 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 BAS 10198351?
The CAS number of BAS 10198351 is 850187-97-2.
What is the molecular formula of BAS 10198351?
The molecular formula of BAS 10198351 is C16H14ClN3O2.
What is the molecular weight of BAS 10198351?
The molecular weight of BAS 10198351 is 315.08 g/mol.
Where can I buy BAS 10198351?
You can request a quote for BAS 10198351 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10198351?
Yes, KEHONG BIO provides custom synthesis services for BAS 10198351 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.