ChemDiv1_013210
TL;DR: ChemDiv1_013210 (CAS 443349-39-1) is a chemical compound with molecular formula C29H25N5O3S and molecular weight 523.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-phenacylsulfanylbenzimidazolo[1,2-c]quinazoline-3-carbonyl)piperidine-4-carboxamide
Also Known As: ChemDiv1_013210, F0916-4298, 1-(6-phenacylsulfanylbenzimidazolo[1,2-c]quinazoline-3-carbonyl)piperidine-4-carboxamide, 1-{9-[(2-oxo-2-phenylethyl)sulfanyl]-8,10,17-triazatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-1(17),2,4,6,8,11(16),12,14-octaene-5-carbonyl}piperidine-4-carboxamide, 1-({6-[(2-oxo-2-phenylethyl)thio]benzimidazo[1,2-c]quinazolin-3-yl}carbonyl)piperidine-4-carboxamide
| Molecular Formula | C29H25N5O3S |
|---|---|
| Molecular Weight | 523.17 g/mol |
| LogP | 4.3482 |
| Topological Polar Surface Area | 110.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 523.1678 |
| Heavy Atoms | 38 |
| Complexity | 1707.8857 |
Chemical Identifiers
| CAS Number | 443349-39-1 |
|---|---|
| SMILES | C1CN(CCC1C(=O)N)C(=O)C2=CC3=C(C=C2)C4=NC5=CC=CC=C5N4C(=N3)SCC(=O)C6=CC=CC=C6 |
Product Overview
ChemDiv1_013210 (CAS 443349-39-1), with molecular formula C29H25N5O3S and molecular weight 523.17 g/mol. IUPAC: 1-(6-phenacylsulfanylbenzimidazolo[1,2-c]quinazoline-3-carbonyl)piperidine-4-carboxamide.
Chemical Property Profile of ChemDiv1_013210
Property Insights of ChemDiv1_013210
The XLogP value of 4.3482 indicates that ChemDiv1_013210 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.66 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_013210. Following Lipinski's Rule of Five, ChemDiv1_013210 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_013210?
The CAS number of ChemDiv1_013210 is 443349-39-1.
What is the molecular formula of ChemDiv1_013210?
The molecular formula of ChemDiv1_013210 is C29H25N5O3S.
What is the molecular weight of ChemDiv1_013210?
The molecular weight of ChemDiv1_013210 is 523.17 g/mol.
Where can I buy ChemDiv1_013210?
You can request a quote for ChemDiv1_013210 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_013210?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_013210 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.