![5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione structure](/static/products/3923/39231-73-7.webp)
5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione
TL;DR: 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione (CAS 39231-73-7) is a chemical compound with molecular formula C18H15NO4S and molecular weight 341.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione
Also Known As: 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione, 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzot, 6-Phenyl-8,9-dihydro-5H-5lambda~6~-pyrrolo[2,1-d][1,5]benzothiazepine-5,5,7,10(6H,7aH)-tetrone
| Molecular Formula | C18H15NO4S |
|---|---|
| Molecular Weight | 341.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 341.07217 |
| Heavy Atoms | 24 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 39231-73-7 |
|---|---|
| SMILES | C1CC(=O)N2C1C(=O)C(S(=O)(=O)C3=CC=CC=C32)C4=CC=CC=C4 |
| InChIKey | OLJKEOLZVMHCEK-UHFFFAOYSA-N |
Product Overview
5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione (CAS 39231-73-7), with molecular formula C18H15NO4S and molecular weight 341.07 g/mol. IUPAC: 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione.
Chemical Property Profile of 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione
Property Insights of 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione. Following Lipinski's Rule of Five, 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione has 0 hydrogen bond donor(s) and 4 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 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione?
The CAS number of 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione is 39231-73-7.
What is the molecular formula of 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione?
The molecular formula of 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione is C18H15NO4S.
What is the molecular weight of 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione?
The molecular weight of 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione is 341.07 g/mol.
Where can I buy 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione?
You can request a quote for 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione?
Yes, KEHONG BIO provides custom synthesis services for 5,5-dioxo-6-phenyl-8,9-dihydro-7aH-pyrrolo[2,1-d][1,5]benzothiazepine-7,10-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.