Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate
TL;DR: Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate (CAS 69195-77-3) is a chemical compound with molecular formula C21H16ClNO2S and molecular weight 381.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl) N-phenylcarbamate
Also Known As: 10,11-Dihydro-8-chlorodibenzo(b,f)thiepin-10-ol phenylcarbamate, Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate, 10-(Anilinocarbonyloxy)-8-chloro-10,11-dihydrodibenzo(b,f)thiepin, (3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl) N-phenylcarbamate, AE-641/30117037
| Molecular Formula | C21H16ClNO2S |
|---|---|
| Molecular Weight | 381.06 g/mol |
| LogP | 6.3371 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 381.05902 |
| Heavy Atoms | 26 |
| Complexity | 945.7509 |
Chemical Identifiers
| CAS Number | 69195-77-3 |
|---|---|
| SMILES | C1C(C2=C(C=CC(=C2)Cl)SC3=CC=CC=C31)OC(=O)NC4=CC=CC=C4 |
Product Overview
Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate (CAS 69195-77-3), with molecular formula C21H16ClNO2S and molecular weight 381.06 g/mol. IUPAC: (3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl) N-phenylcarbamate.
Chemical Property Profile of Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate
Property Insights of Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate
The XLogP value of 6.3371 indicates that Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate?
The CAS number of Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate is 69195-77-3.
What is the molecular formula of Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate?
The molecular formula of Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate is C21H16ClNO2S.
What is the molecular weight of Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate?
The molecular weight of Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate is 381.06 g/mol.
Where can I buy Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate?
You can request a quote for Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-8-chloro-, phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.