AB00669936-01
TL;DR: AB00669936-01 (CAS 862825-73-8) is a chemical compound with molecular formula C25H20BrN3OS2 and molecular weight 521.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
Also Known As: AB00669936-01, F0616-0160, 2-({1-[(4-bromophenyl)methyl]-1H-indol-3-yl}sulfanyl)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide, 2-((1-(4-bromobenzyl)-1H-indol-3-yl)thio)-N-(6-methylbenzo[d]thiazol-2-yl)acetamide, 2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
| Molecular Formula | C25H20BrN3OS2 |
|---|---|
| Molecular Weight | 521.02 g/mol |
| LogP | 7.10102 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 521.02313 |
| Heavy Atoms | 32 |
| Complexity | 1422.7194 |
Chemical Identifiers
| CAS Number | 862825-73-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CN(C4=CC=CC=C43)CC5=CC=C(C=C5)Br |
Product Overview
AB00669936-01 (CAS 862825-73-8), with molecular formula C25H20BrN3OS2 and molecular weight 521.02 g/mol. IUPAC: 2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide.
Chemical Property Profile of AB00669936-01
Property Insights of AB00669936-01
The XLogP value of 7.10102 indicates that AB00669936-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, AB00669936-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00669936-01 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00669936-01?
The CAS number of AB00669936-01 is 862825-73-8.
What is the molecular formula of AB00669936-01?
The molecular formula of AB00669936-01 is C25H20BrN3OS2.
What is the molecular weight of AB00669936-01?
The molecular weight of AB00669936-01 is 521.02 g/mol.
Where can I buy AB00669936-01?
You can request a quote for AB00669936-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00669936-01?
Yes, KEHONG BIO provides custom synthesis services for AB00669936-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.