BAS 06399229
TL;DR: BAS 06399229 (CAS 604747-26-4) is a chemical compound with molecular formula C19H18N4O2S2 and molecular weight 398.09 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-thiadiazol-2-yl]-4-methylbenzamide
Also Known As: BAS 06399229, F1838-2886, N-(5-{[(BENZYLCARBAMOYL)METHYL]SULFANYL}-1,3,4-THIADIAZOL-2-YL)-4-METHYLBENZAMIDE, N-(5-((2-(benzylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-4-methylbenzamide, N-[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-methylbenzamide
| Molecular Formula | C19H18N4O2S2 |
|---|---|
| Molecular Weight | 398.09 g/mol |
| LogP | 3.50732 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 398.08713 |
| Heavy Atoms | 27 |
| Complexity | 910.9738 |
Chemical Identifiers
| CAS Number | 604747-26-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)NCC3=CC=CC=C3 |
Product Overview
BAS 06399229 (CAS 604747-26-4), with molecular formula C19H18N4O2S2 and molecular weight 398.09 g/mol. IUPAC: N-[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-methylbenzamide.
Chemical Property Profile of BAS 06399229
Property Insights of BAS 06399229
The XLogP value of 3.50732 indicates that BAS 06399229 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 06399229. Following Lipinski's Rule of Five, BAS 06399229 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 06399229?
The CAS number of BAS 06399229 is 604747-26-4.
What is the molecular formula of BAS 06399229?
The molecular formula of BAS 06399229 is C19H18N4O2S2.
What is the molecular weight of BAS 06399229?
The molecular weight of BAS 06399229 is 398.09 g/mol.
Where can I buy BAS 06399229?
You can request a quote for BAS 06399229 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06399229?
Yes, KEHONG BIO provides custom synthesis services for BAS 06399229 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.