9-Ethyl-3-isothiocyanato-9H-carbazole
TL;DR: 9-Ethyl-3-isothiocyanato-9H-carbazole (CAS 95756-56-2) is a chemical compound with molecular formula C15H12N2S and molecular weight 252.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-ethyl-3-isothiocyanatocarbazole
Also Known As: 9-Ethyl-3-isothiocyanato-9H-carbazole, 9-ethyl-3-isothiocyanatocarbazole
| Molecular Formula | C15H12N2S |
|---|---|
| Molecular Weight | 252.07 g/mol |
| LogP | 4.5487 |
| Topological Polar Surface Area | 17.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.07211 |
| Heavy Atoms | 18 |
| Complexity | 779.63885 |
Chemical Identifiers
| CAS Number | 95756-56-2 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)N=C=S)C3=CC=CC=C31 |
Product Overview
9-Ethyl-3-isothiocyanato-9H-carbazole (CAS 95756-56-2), with molecular formula C15H12N2S and molecular weight 252.07 g/mol. IUPAC: 9-ethyl-3-isothiocyanatocarbazole.
Chemical Property Profile of 9-Ethyl-3-isothiocyanato-9H-carbazole
Property Insights of 9-Ethyl-3-isothiocyanato-9H-carbazole
The XLogP value of 4.5487 indicates that 9-Ethyl-3-isothiocyanato-9H-carbazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.29 Ų, 9-Ethyl-3-isothiocyanato-9H-carbazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Ethyl-3-isothiocyanato-9H-carbazole has 0 hydrogen bond donor(s) and 2 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 9-Ethyl-3-isothiocyanato-9H-carbazole?
The CAS number of 9-Ethyl-3-isothiocyanato-9H-carbazole is 95756-56-2.
What is the molecular formula of 9-Ethyl-3-isothiocyanato-9H-carbazole?
The molecular formula of 9-Ethyl-3-isothiocyanato-9H-carbazole is C15H12N2S.
What is the molecular weight of 9-Ethyl-3-isothiocyanato-9H-carbazole?
The molecular weight of 9-Ethyl-3-isothiocyanato-9H-carbazole is 252.07 g/mol.
Where can I buy 9-Ethyl-3-isothiocyanato-9H-carbazole?
You can request a quote for 9-Ethyl-3-isothiocyanato-9H-carbazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Ethyl-3-isothiocyanato-9H-carbazole?
Yes, KEHONG BIO provides custom synthesis services for 9-Ethyl-3-isothiocyanato-9H-carbazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.