2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one
TL;DR: 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one (CAS 105544-96-5) is a chemical compound with molecular formula C10H10N2OS2 and molecular weight 238.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one
Also Known As: (R)-3-Benzyloxy-pentan-2-one, 2-amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one, BAS 02072512, 2-amino-5,6,7,8-tetrahydro-4H-[1]benzothieno[2,3-d][1,3]thiazin-4-one, 3-methoxycarbonyl-4-(2,3,4-trimethoxyphenyl)but-3-enoate
| Molecular Formula | C10H10N2OS2 |
|---|---|
| Molecular Weight | 238.02 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 238.02345 |
| Heavy Atoms | 15 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 105544-96-5 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=C(SC3=O)N |
| InChIKey | CLDVQGQXZUANQB-UHFFFAOYSA-N |
Product Overview
2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one (CAS 105544-96-5), with molecular formula C10H10N2OS2 and molecular weight 238.02 g/mol. IUPAC: 2-amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one.
Chemical Property Profile of 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one
Property Insights of 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one. Following Lipinski's Rule of Five, 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one 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 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one?
The CAS number of 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one is 105544-96-5.
What is the molecular formula of 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one?
The molecular formula of 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one is C10H10N2OS2.
What is the molecular weight of 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one?
The molecular weight of 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one is 238.02 g/mol.
Where can I buy 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one?
You can request a quote for 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]thiazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.