ChemDiv3_007862
TL;DR: ChemDiv3_007862 (CAS 686737-89-3) is a chemical compound with molecular formula C21H21ClN2O5S2 and molecular weight 480.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-chlorophenyl)sulfonyl-2-(furan-2-yl)-1,3-oxazol-5-yl]sulfanyl]-N-cyclohexylacetamide
Also Known As: ChemDiv3_007862, IDI1_025772, BRD-K76772871-001-01-2, 2-({4-[(4-chlorophenyl)sulfonyl]-2-(furan-2-yl)-1,3-oxazol-5-yl}sulfanyl)-N-cyclohexylacetamide, 2-[[4-(4-chlorophenyl)sulfonyl-2-(furan-2-yl)-1,3-oxazol-5-yl]sulfanyl]-N-cyclohexylacetamide
| Molecular Formula | C21H21ClN2O5S2 |
|---|---|
| Molecular Weight | 480.06 g/mol |
| LogP | 4.9618 |
| Topological Polar Surface Area | 102.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 480.05804 |
| Heavy Atoms | 31 |
| Complexity | 1135.1608 |
Chemical Identifiers
| CAS Number | 686737-89-3 |
|---|---|
| SMILES | C1CCC(CC1)NC(=O)CSC2=C(N=C(O2)C3=CC=CO3)S(=O)(=O)C4=CC=C(C=C4)Cl |
Product Overview
ChemDiv3_007862 (CAS 686737-89-3), with molecular formula C21H21ClN2O5S2 and molecular weight 480.06 g/mol. IUPAC: 2-[[4-(4-chlorophenyl)sulfonyl-2-(furan-2-yl)-1,3-oxazol-5-yl]sulfanyl]-N-cyclohexylacetamide.
Chemical Property Profile of ChemDiv3_007862
Property Insights of ChemDiv3_007862
The XLogP value of 4.9618 indicates that ChemDiv3_007862 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.41 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_007862. Following Lipinski's Rule of Five, ChemDiv3_007862 has 1 hydrogen bond donor(s) and 7 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 ChemDiv3_007862?
The CAS number of ChemDiv3_007862 is 686737-89-3.
What is the molecular formula of ChemDiv3_007862?
The molecular formula of ChemDiv3_007862 is C21H21ClN2O5S2.
What is the molecular weight of ChemDiv3_007862?
The molecular weight of ChemDiv3_007862 is 480.06 g/mol.
Where can I buy ChemDiv3_007862?
You can request a quote for ChemDiv3_007862 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_007862?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_007862 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.