A1385/0061911
TL;DR: A1385/0061911 (CAS 5798-57-2) is a chemical compound with molecular formula C27H27N3O2S2 and molecular weight 489.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[2-(2,6-diethylanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-3-methylbenzamide
Also Known As: A1385/0061911, N-(2-{[2-(2,6-Diethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-methylbenzamide, N-[2-[2-(2,6-diethylanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-3-methylbenzamide, N-[2-({[(2,6-DIETHYLPHENYL)CARBAMOYL]METHYL}SULFANYL)-1,3-BENZOTHIAZOL-6-YL]-3-METHYLBENZAMIDE, N-[2-({2-[(2,6-diethylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]-3-methylbenzamide
| Molecular Formula | C27H27N3O2S2 |
|---|---|
| Molecular Weight | 489.15 g/mol |
| LogP | 6.71262 |
| Topological Polar Surface Area | 71.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 489.15448 |
| Heavy Atoms | 34 |
| Complexity | 1324.7202 |
Chemical Identifiers
| CAS Number | 5798-57-2 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CC(=C4)C |
Product Overview
A1385/0061911 (CAS 5798-57-2), with molecular formula C27H27N3O2S2 and molecular weight 489.15 g/mol. IUPAC: N-[2-[2-(2,6-diethylanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-3-methylbenzamide.
Chemical Property Profile of A1385/0061911
Property Insights of A1385/0061911
The XLogP value of 6.71262 indicates that A1385/0061911 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.09 Ų falls within the moderate polarity range, balancing permeability and solubility for A1385/0061911. Following Lipinski's Rule of Five, A1385/0061911 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1385/0061911?
The CAS number of A1385/0061911 is 5798-57-2.
What is the molecular formula of A1385/0061911?
The molecular formula of A1385/0061911 is C27H27N3O2S2.
What is the molecular weight of A1385/0061911?
The molecular weight of A1385/0061911 is 489.15 g/mol.
Where can I buy A1385/0061911?
You can request a quote for A1385/0061911 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1385/0061911?
Yes, KEHONG BIO provides custom synthesis services for A1385/0061911 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.