ChemDiv1_011534
TL;DR: ChemDiv1_011534 (CAS 312287-08-4) is a chemical compound with molecular formula C22H17N5O2 and molecular weight 383.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-3-(3-ethoxy-4-methoxyphenyl)pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile
Also Known As: ChemDiv1_011534, BAS 00770983, 1-amino-3-(3-ethoxy-4-methoxyphenyl)pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile, AB00100205-01, A1791/0075915
| Molecular Formula | C22H17N5O2 |
|---|---|
| Molecular Weight | 383.14 g/mol |
| LogP | 3.88736 |
| Topological Polar Surface Area | 109.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.1382 |
| Heavy Atoms | 29 |
| Complexity | 1341.8068 |
Chemical Identifiers
| CAS Number | 312287-08-4 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2=C(C3=NC4=CC=CC=C4N3C(=C2C#N)N)C#N)OC |
Product Overview
ChemDiv1_011534 (CAS 312287-08-4), with molecular formula C22H17N5O2 and molecular weight 383.14 g/mol. IUPAC: 1-amino-3-(3-ethoxy-4-methoxyphenyl)pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile.
Chemical Property Profile of ChemDiv1_011534
Property Insights of ChemDiv1_011534
The XLogP value of 3.88736 indicates that ChemDiv1_011534 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.36 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_011534. Following Lipinski's Rule of Five, ChemDiv1_011534 has 1 hydrogen bond donor(s) and 6 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 ChemDiv1_011534?
The CAS number of ChemDiv1_011534 is 312287-08-4.
What is the molecular formula of ChemDiv1_011534?
The molecular formula of ChemDiv1_011534 is C22H17N5O2.
What is the molecular weight of ChemDiv1_011534?
The molecular weight of ChemDiv1_011534 is 383.14 g/mol.
Where can I buy ChemDiv1_011534?
You can request a quote for ChemDiv1_011534 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_011534?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_011534 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.