BAS 13120204
TL;DR: BAS 13120204 (CAS 477498-98-9) is a chemical compound with molecular formula C23H22N2O3S3 and molecular weight 470.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxyphenyl]-4-tert-butylbenzenesulfonamide
Also Known As: BAS 13120204, N-[3-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxyphenyl]-4-tert-butylbenzenesulfonamide, AQ-390/40898038, N-[3-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxyphenyl]-4-tert-butylbenzene-1-sulfonamide, F0808-0154
| Molecular Formula | C23H22N2O3S3 |
|---|---|
| Molecular Weight | 470.08 g/mol |
| LogP | 6.2514 |
| Topological Polar Surface Area | 79.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 470.07925 |
| Heavy Atoms | 31 |
| Complexity | 1305.757 |
Chemical Identifiers
| CAS Number | 477498-98-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)O)SC3=NC4=CC=CC=C4S3 |
Product Overview
BAS 13120204 (CAS 477498-98-9), with molecular formula C23H22N2O3S3 and molecular weight 470.08 g/mol. IUPAC: N-[3-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxyphenyl]-4-tert-butylbenzenesulfonamide.
Chemical Property Profile of BAS 13120204
Property Insights of BAS 13120204
The XLogP value of 6.2514 indicates that BAS 13120204 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.29 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13120204. Following Lipinski's Rule of Five, BAS 13120204 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 13120204?
The CAS number of BAS 13120204 is 477498-98-9.
What is the molecular formula of BAS 13120204?
The molecular formula of BAS 13120204 is C23H22N2O3S3.
What is the molecular weight of BAS 13120204?
The molecular weight of BAS 13120204 is 470.08 g/mol.
Where can I buy BAS 13120204?
You can request a quote for BAS 13120204 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13120204?
Yes, KEHONG BIO provides custom synthesis services for BAS 13120204 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.