ChemDiv2_006098
TL;DR: ChemDiv2_006098 (CAS 851411-72-8) is a chemical compound with molecular formula C24H21N3O5S and molecular weight 463.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methyl-5-oxochromeno[4,3-b]pyridin-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide
Also Known As: ChemDiv2_006098, IDI1_004813, N-(4-methyl-5-oxochromeno[4,3-b]pyridin-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide, N-(4-methyl-5-oxo-2-[1]benzopyrano[4,3-b]pyridinyl)-4-(1-pyrrolidinylsulfonyl)benzamide, N-(4-methyl-5-oxo-5H-chromeno[4,3-b]pyridin-2-yl)-4-(pyrrolidin-1-ylsulfonyl)benzamide
| Molecular Formula | C24H21N3O5S |
|---|---|
| Molecular Weight | 463.12 g/mol |
| LogP | 3.68642 |
| Topological Polar Surface Area | 109.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 463.12018 |
| Heavy Atoms | 33 |
| Complexity | 1553.387 |
Chemical Identifiers
| CAS Number | 851411-72-8 |
|---|---|
| SMILES | CC1=CC(=NC2=C1C(=O)OC3=CC=CC=C32)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5 |
Product Overview
ChemDiv2_006098 (CAS 851411-72-8), with molecular formula C24H21N3O5S and molecular weight 463.12 g/mol. IUPAC: N-(4-methyl-5-oxochromeno[4,3-b]pyridin-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide.
Chemical Property Profile of ChemDiv2_006098
Property Insights of ChemDiv2_006098
The XLogP value of 3.68642 indicates that ChemDiv2_006098 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.58 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_006098. Following Lipinski's Rule of Five, ChemDiv2_006098 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 ChemDiv2_006098?
The CAS number of ChemDiv2_006098 is 851411-72-8.
What is the molecular formula of ChemDiv2_006098?
The molecular formula of ChemDiv2_006098 is C24H21N3O5S.
What is the molecular weight of ChemDiv2_006098?
The molecular weight of ChemDiv2_006098 is 463.12 g/mol.
Where can I buy ChemDiv2_006098?
You can request a quote for ChemDiv2_006098 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_006098?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_006098 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.