2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone
TL;DR: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone (CAS 532938-11-7) is a chemical compound with molecular formula C21H23N3OS2 and molecular weight 397.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone
Also Known As: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone, 2-((6-aminobenzo[d]thiazol-2-yl)thio)-1-(3,4,5,6,7,8-hexahydro-1H-carbazol-9(2H)-yl)ethanone, 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydro-9H-carbazol-9-yl)ethanone
| Molecular Formula | C21H23N3OS2 |
|---|---|
| Molecular Weight | 397.13 g/mol |
| LogP | 4.8701 |
| Topological Polar Surface Area | 60.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 397.12827 |
| Heavy Atoms | 27 |
| Complexity | 1000.39307 |
Chemical Identifiers
| CAS Number | 532938-11-7 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(N2C(=O)CSC4=NC5=C(S4)C=C(C=C5)N)CCCC3 |
Product Overview
2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone (CAS 532938-11-7), with molecular formula C21H23N3OS2 and molecular weight 397.13 g/mol. IUPAC: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone.
Chemical Property Profile of 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone
Property Insights of 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone
The XLogP value of 4.8701 indicates that 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone. Following Lipinski's Rule of Five, 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone?
The CAS number of 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone is 532938-11-7.
What is the molecular formula of 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone?
The molecular formula of 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone is C21H23N3OS2.
What is the molecular weight of 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone?
The molecular weight of 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone is 397.13 g/mol.
Where can I buy 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone?
You can request a quote for 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(1,2,3,4,5,6,7,8-octahydrocarbazol-9-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.