BAS 01174046
TL;DR: BAS 01174046 (CAS 314040-03-4) is a chemical compound with molecular formula C23H22N2O2S2 and molecular weight 422.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4-tetrahydrocarbazol-9-yl)ethanone
Also Known As: BAS 01174046, 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethanone, AJ-292/13095474, BRD-K25731684-001-01-7, 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4-tetrahydrocarbazol-9-yl)ethanone
| Molecular Formula | C23H22N2O2S2 |
|---|---|
| Molecular Weight | 422.11 g/mol |
| LogP | 5.961 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.11227 |
| Heavy Atoms | 29 |
| Complexity | 1208.5098 |
Chemical Identifiers
| CAS Number | 314040-03-4 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3C4=C(CCCC4)C5=CC=CC=C53 |
Product Overview
BAS 01174046 (CAS 314040-03-4), with molecular formula C23H22N2O2S2 and molecular weight 422.11 g/mol. IUPAC: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4-tetrahydrocarbazol-9-yl)ethanone.
Chemical Property Profile of BAS 01174046
Property Insights of BAS 01174046
The XLogP value of 5.961 indicates that BAS 01174046 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, BAS 01174046 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01174046 has 0 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 BAS 01174046?
The CAS number of BAS 01174046 is 314040-03-4.
What is the molecular formula of BAS 01174046?
The molecular formula of BAS 01174046 is C23H22N2O2S2.
What is the molecular weight of BAS 01174046?
The molecular weight of BAS 01174046 is 422.11 g/mol.
Where can I buy BAS 01174046?
You can request a quote for BAS 01174046 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01174046?
Yes, KEHONG BIO provides custom synthesis services for BAS 01174046 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.