2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide
TL;DR: 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide (CAS 862980-04-9) is a chemical compound with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide
Also Known As: ChemDiv3_010784, IDI1_028342, F0670-0007, 2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide, BRD-K54098893-001-01-2
| Molecular Formula | C11H12N2O2S |
|---|---|
| Molecular Weight | 236.06 g/mol |
| LogP | 1.0007 |
| Topological Polar Surface Area | 63.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.06195 |
| Heavy Atoms | 16 |
| Complexity | 433.74768 |
Chemical Identifiers
| CAS Number | 862980-04-9 |
|---|---|
| SMILES | C1CSC2=CC=CC=C2N(C1=O)CC(=O)N |
Product Overview
2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide (CAS 862980-04-9), with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol. IUPAC: 2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide.
Chemical Property Profile of 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide
Property Insights of 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide
The XLogP value of 1.0007 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide. The TPSA of 63.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide. Following Lipinski's Rule of Five, 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide 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 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide?
The CAS number of 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide is 862980-04-9.
What is the molecular formula of 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide?
The molecular formula of 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide is C11H12N2O2S.
What is the molecular weight of 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide?
The molecular weight of 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide is 236.06 g/mol.
Where can I buy 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide?
You can request a quote for 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.