1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-
TL;DR: 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro- (CAS 89813-89-8) is a chemical compound with molecular formula C17H17NO3S and molecular weight 315.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one
Also Known As: 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-, 2-(3,4-dimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one, 2,3-Dihydro-2-(3,4-dimethoxyphenyl)-1,5-benzothiazepin-4(5H)-one, 2-(3,4-Dimethoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-one
| Molecular Formula | C17H17NO3S |
|---|---|
| Molecular Weight | 315.09 g/mol |
| LogP | 3.8794 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.09293 |
| Heavy Atoms | 22 |
| Complexity | 702.05347 |
Chemical Identifiers
| CAS Number | 89813-89-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2CC(=O)NC3=CC=CC=C3S2)OC |
Product Overview
1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro- (CAS 89813-89-8), with molecular formula C17H17NO3S and molecular weight 315.09 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one.
Chemical Property Profile of 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-
Property Insights of 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-
The XLogP value of 3.8794 indicates that 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro- has 1 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 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-?
The CAS number of 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro- is 89813-89-8.
What is the molecular formula of 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-?
The molecular formula of 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro- is C17H17NO3S.
What is the molecular weight of 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-?
The molecular weight of 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro- is 315.09 g/mol.
Where can I buy 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-?
You can request a quote for 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Benzothiazepin-4(5H)-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.