ChemDiv3_008841
TL;DR: ChemDiv3_008841 (CAS 851862-45-8) is a chemical compound with molecular formula C17H16N4O4S and molecular weight 372.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]furan-2-carboxamide
Also Known As: ChemDiv3_008841, IDI1_026751, BRD-K90792878-001-01-5, F0623-0756, N-((5-((2-(benzylamino)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)methyl)furan-2-carboxamide
| Molecular Formula | C17H16N4O4S |
|---|---|
| Molecular Weight | 372.09 g/mol |
| LogP | 2.0011 |
| Topological Polar Surface Area | 110.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 372.08923 |
| Heavy Atoms | 26 |
| Complexity | 848.7971 |
Chemical Identifiers
| CAS Number | 851862-45-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)CSC2=NN=C(O2)CNC(=O)C3=CC=CO3 |
Product Overview
ChemDiv3_008841 (CAS 851862-45-8), with molecular formula C17H16N4O4S and molecular weight 372.09 g/mol. IUPAC: N-[[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]furan-2-carboxamide.
Chemical Property Profile of ChemDiv3_008841
Property Insights of ChemDiv3_008841
The XLogP value of 2.0011 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_008841. The TPSA of 110.26 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_008841. Following Lipinski's Rule of Five, ChemDiv3_008841 has 2 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_008841?
The CAS number of ChemDiv3_008841 is 851862-45-8.
What is the molecular formula of ChemDiv3_008841?
The molecular formula of ChemDiv3_008841 is C17H16N4O4S.
What is the molecular weight of ChemDiv3_008841?
The molecular weight of ChemDiv3_008841 is 372.09 g/mol.
Where can I buy ChemDiv3_008841?
You can request a quote for ChemDiv3_008841 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_008841?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_008841 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.