7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one
TL;DR: 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one (CAS 153528-11-1) is a chemical compound with molecular formula C10H10ClNOS and molecular weight 227.01717 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one
Also Known As: 7-chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one, 10N-321S, 7-chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4(5H)-one, 7-chloro-5-methyl-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-one
Technical Specifications
| Molecular Formula | C10H10ClNOS |
| Molecular Weight | 227.01717 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 45.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 227.01717 Da |
| Heavy Atoms | 14 |
| Complexity | 236.0 |
| SMILES | CN1C(=O)CCSC2=C1C=C(C=C2)Cl |
| InChIKey | VKUDNFNYYWAVQR-UHFFFAOYSA-N |
Chemical Property Profile of 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one
Property Insights of 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one. With a topological polar surface area (TPSA) of 45.6 Ų, 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one 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
What is the CAS number of 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one?
The CAS number of 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one is 153528-11-1.
What is the molecular formula of 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one?
The molecular formula of 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one is C10H10ClNOS.
What is the molecular weight of 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one?
The molecular weight of 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one is 227.01717 g/mol.
Where can I buy 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one?
You can request a quote for 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one?
Yes, CoreyChem provides custom synthesis services for 7-Chloro-5-methyl-2,3-dihydro-1,5-benzothiazepin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.