BAS 06398899
TL;DR: BAS 06398899 (CAS 530152-73-9) is a chemical compound with molecular formula C17H22N4O2S2 and molecular weight 378.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-(tert-butylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide
Also Known As: BAS 06398899, N-(5-((2-(tert-butylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide, N-[5-[2-(tert-butylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide, N-[5-(tert-Butylcarbamoyl-methylsulfanyl)-[1,3,4]thiadiazol-2-yl]-3-phenyl-propionamide, N-(5-{[(TERT-BUTYLCARBAMOYL)METHYL]SULFANYL}-1,3,4-THIADIAZOL-2-YL)-3-PHENYLPROPANAMIDE
| Molecular Formula | C17H22N4O2S2 |
|---|---|
| Molecular Weight | 378.12 g/mol |
| LogP | 3.1162 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 378.1184 |
| Heavy Atoms | 25 |
| Complexity | 710.938 |
Chemical Identifiers
| CAS Number | 530152-73-9 |
|---|---|
| SMILES | CC(C)(C)NC(=O)CSC1=NN=C(S1)NC(=O)CCC2=CC=CC=C2 |
Product Overview
BAS 06398899 (CAS 530152-73-9), with molecular formula C17H22N4O2S2 and molecular weight 378.12 g/mol. IUPAC: N-[5-[2-(tert-butylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide.
Chemical Property Profile of BAS 06398899
Property Insights of BAS 06398899
The XLogP value of 3.1162 indicates that BAS 06398899 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06398899. Following Lipinski's Rule of Five, BAS 06398899 has 2 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 BAS 06398899?
The CAS number of BAS 06398899 is 530152-73-9.
What is the molecular formula of BAS 06398899?
The molecular formula of BAS 06398899 is C17H22N4O2S2.
What is the molecular weight of BAS 06398899?
The molecular weight of BAS 06398899 is 378.12 g/mol.
Where can I buy BAS 06398899?
You can request a quote for BAS 06398899 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06398899?
Yes, KEHONG BIO provides custom synthesis services for BAS 06398899 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.