Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide
TL;DR: Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide (CAS 110129-24-3) is a chemical compound with molecular formula C16H15NO3S and molecular weight 301.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-6,6-dioxo-5,7-dihydrobenzo[d][2]benzothiepine-5-carboxamide
Also Known As: N-Methyl-6,6-dioxido-5,7-dihydrodibenzo(c,e)thiepin-5-carboxamide, AE-641/30155021, Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide, N-methyl-6,6-dioxo-5,7-dihydrobenzo[d][2]benzothiepine-5-carboxamide, Dibenzo[c,e]thiepin-5-carboxamide,5,7-dihydro-N-methyl-, 6,6-dioxide
| Molecular Formula | C16H15NO3S |
|---|---|
| Molecular Weight | 301.08 g/mol |
| LogP | 2.0691 |
| Topological Polar Surface Area | 63.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 301.07727 |
| Heavy Atoms | 21 |
| Complexity | 811.77673 |
Chemical Identifiers
| CAS Number | 110129-24-3 |
|---|---|
| SMILES | CNC(=O)C1C2=CC=CC=C2C3=CC=CC=C3CS1(=O)=O |
Product Overview
Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide (CAS 110129-24-3), with molecular formula C16H15NO3S and molecular weight 301.08 g/mol. IUPAC: N-methyl-6,6-dioxo-5,7-dihydrobenzo[d][2]benzothiepine-5-carboxamide.
Chemical Property Profile of Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide
Property Insights of Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide
The XLogP value of 2.0691 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide. The TPSA of 63.24 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide. Following Lipinski's Rule of Five, Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide has 1 hydrogen bond donor(s) and 3 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 Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide?
The CAS number of Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide is 110129-24-3.
What is the molecular formula of Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide?
The molecular formula of Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide is C16H15NO3S.
What is the molecular weight of Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide?
The molecular weight of Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide is 301.08 g/mol.
Where can I buy Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide?
You can request a quote for Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide?
Yes, KEHONG BIO provides custom synthesis services for Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.