A2166/0091000
TL;DR: A2166/0091000 (CAS 309290-67-3) is a chemical compound with molecular formula C24H22BrN3O2S2 and molecular weight 527.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-[2-[2-oxo-2-(1,2,3,4-tetrahydrocarbazol-9-yl)ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide
Also Known As: A2166/0091000, 2-bromo-N-(2-((2-(3,4-dihydro-1H-carbazol-9(2H)-yl)-2-oxoethyl)thio)benzo[d]thiazol-6-yl)propanamide, 2-bromo-N-(2-{[2-oxo-2-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide, 2-BROMO-N-(2-{[2-OXO-2-(2,3,4,9-TETRAHYDRO-1H-CARBAZOL-9-YL)ETHYL]SULFANYL}-1,3-BENZOTHIAZOL-6-YL)PROPANAMIDE, 2-bromo-N-[2-[2-oxo-2-(1,2,3,4-tetrahydrocarbazol-9-yl)ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide
| Molecular Formula | C24H22BrN3O2S2 |
|---|---|
| Molecular Weight | 527.03 g/mol |
| LogP | 6.2842 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 527.0337 |
| Heavy Atoms | 32 |
| Complexity | 1342.0228 |
Chemical Identifiers
| CAS Number | 309290-67-3 |
|---|---|
| SMILES | CC(C(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3C4=C(CCCC4)C5=CC=CC=C53)Br |
Product Overview
A2166/0091000 (CAS 309290-67-3), with molecular formula C24H22BrN3O2S2 and molecular weight 527.03 g/mol. IUPAC: 2-bromo-N-[2-[2-oxo-2-(1,2,3,4-tetrahydrocarbazol-9-yl)ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide.
Chemical Property Profile of A2166/0091000
Property Insights of A2166/0091000
The XLogP value of 6.2842 indicates that A2166/0091000 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for A2166/0091000. Following Lipinski's Rule of Five, A2166/0091000 has 1 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 A2166/0091000?
The CAS number of A2166/0091000 is 309290-67-3.
What is the molecular formula of A2166/0091000?
The molecular formula of A2166/0091000 is C24H22BrN3O2S2.
What is the molecular weight of A2166/0091000?
The molecular weight of A2166/0091000 is 527.03 g/mol.
Where can I buy A2166/0091000?
You can request a quote for A2166/0091000 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2166/0091000?
Yes, KEHONG BIO provides custom synthesis services for A2166/0091000 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.