11K-634S
TL;DR: 11K-634S (CAS 303147-94-6) is a chemical compound with molecular formula C24H18ClN3O3S2 and molecular weight 495.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[6-[(4-chlorophenyl)sulfinylmethyl]-2-pyridin-4-ylpyrimidin-4-yl]sulfanylbenzoate
Also Known As: 11K-634S, methyl 2-[6-[(4-chlorophenyl)sulfinylmethyl]-2-pyridin-4-ylpyrimidin-4-yl]sulfanylbenzoate, methyl 2-{[6-{[(4-chlorophenyl)sulfinyl]methyl}-2-(4-pyridinyl)-4-pyrimidinyl]sulfanyl}benzenecarboxylate, Methyl 2-[6-[(4-chlorophenyl)sulfinylmethyl]-2-pyridin-4-yl-pyrimidin-4-yl]sulfanylbenzoate, methyl 2-({6-[(4-chlorobenzenesulfinyl)methyl]-2-(pyridin-4-yl)pyrimidin-4-yl}sulfanyl)benzoate
| Molecular Formula | C24H18ClN3O3S2 |
|---|---|
| Molecular Weight | 495.05 g/mol |
| LogP | 5.4376 |
| Topological Polar Surface Area | 82.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 495.04782 |
| Heavy Atoms | 33 |
| Complexity | 1302.1112 |
Chemical Identifiers
| CAS Number | 303147-94-6 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1SC2=NC(=NC(=C2)CS(=O)C3=CC=C(C=C3)Cl)C4=CC=NC=C4 |
Product Overview
11K-634S (CAS 303147-94-6), with molecular formula C24H18ClN3O3S2 and molecular weight 495.05 g/mol. IUPAC: methyl 2-[6-[(4-chlorophenyl)sulfinylmethyl]-2-pyridin-4-ylpyrimidin-4-yl]sulfanylbenzoate.
Chemical Property Profile of 11K-634S
Property Insights of 11K-634S
The XLogP value of 5.4376 indicates that 11K-634S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 11K-634S. Following Lipinski's Rule of Five, 11K-634S has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11K-634S?
The CAS number of 11K-634S is 303147-94-6.
What is the molecular formula of 11K-634S?
The molecular formula of 11K-634S is C24H18ClN3O3S2.
What is the molecular weight of 11K-634S?
The molecular weight of 11K-634S is 495.05 g/mol.
Where can I buy 11K-634S?
You can request a quote for 11K-634S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11K-634S?
Yes, KEHONG BIO provides custom synthesis services for 11K-634S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.