BAS 06398717
TL;DR: BAS 06398717 (CAS 604746-31-8) is a chemical compound with molecular formula C15H18N4O3S2 and molecular weight 366.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]furan-2-carboxamide
Also Known As: BAS 06398717, Furan-2-carboxylic acid (5-cyclohexylcarbamoylmethylsulfanyl-[1,3,4]thiadiazol-2-yl)-amide, N-[5-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]furan-2-carboxamide, N-(5-{[(CYCLOHEXYLCARBAMOYL)METHYL]SULFANYL}-1,3,4-THIADIAZOL-2-YL)FURAN-2-CARBOXAMIDE, N-(5-((2-(cyclohexylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
| Molecular Formula | C15H18N4O3S2 |
|---|---|
| Molecular Weight | 366.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 366.08203 |
| Heavy Atoms | 24 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 604746-31-8 |
|---|---|
| SMILES | C1CCC(CC1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=CO3 |
| InChIKey | FIHMDSVQACSROL-UHFFFAOYSA-N |
Product Overview
BAS 06398717 (CAS 604746-31-8), with molecular formula C15H18N4O3S2 and molecular weight 366.08 g/mol. IUPAC: N-[5-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]furan-2-carboxamide.
Chemical Property Profile of BAS 06398717
Property Insights of BAS 06398717
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06398717. The TPSA of 151.0 Ų indicates high polarity, suggesting BAS 06398717 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 06398717 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 BAS 06398717?
The CAS number of BAS 06398717 is 604746-31-8.
What is the molecular formula of BAS 06398717?
The molecular formula of BAS 06398717 is C15H18N4O3S2.
What is the molecular weight of BAS 06398717?
The molecular weight of BAS 06398717 is 366.08 g/mol.
Where can I buy BAS 06398717?
You can request a quote for BAS 06398717 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06398717?
Yes, KEHONG BIO provides custom synthesis services for BAS 06398717 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.