AB00670913-01
TL;DR: AB00670913-01 (CAS 862976-05-4) is a chemical compound with molecular formula C16H14FN3OS2 and molecular weight 347.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-fluoro-1,3-benzothiazol-2-yl)amino]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one
Also Known As: AB00670913-01, F0646-3913, 2-[(6-fluoro-1,3-benzothiazol-2-yl)amino]-5,5-dimethyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-one, 2-((6-fluorobenzo[d]thiazol-2-yl)amino)-5,5-dimethyl-5,6-dihydrobenzo[d]thiazol-7(4H)-one, 2-[(6-fluoro-1,3-benzothiazol-2-yl)amino]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one
| Molecular Formula | C16H14FN3OS2 |
|---|---|
| Molecular Weight | 347.06 g/mol |
| LogP | 4.7906 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 347.05624 |
| Heavy Atoms | 23 |
| Complexity | 928.6982 |
Chemical Identifiers
| CAS Number | 862976-05-4 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)SC(=N2)NC3=NC4=C(S3)C=C(C=C4)F)C |
Product Overview
AB00670913-01 (CAS 862976-05-4), with molecular formula C16H14FN3OS2 and molecular weight 347.06 g/mol. IUPAC: 2-[(6-fluoro-1,3-benzothiazol-2-yl)amino]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one.
Chemical Property Profile of AB00670913-01
Property Insights of AB00670913-01
The XLogP value of 4.7906 indicates that AB00670913-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, AB00670913-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00670913-01 has 1 hydrogen bond donor(s) and 6 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 AB00670913-01?
The CAS number of AB00670913-01 is 862976-05-4.
What is the molecular formula of AB00670913-01?
The molecular formula of AB00670913-01 is C16H14FN3OS2.
What is the molecular weight of AB00670913-01?
The molecular weight of AB00670913-01 is 347.06 g/mol.
Where can I buy AB00670913-01?
You can request a quote for AB00670913-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00670913-01?
Yes, KEHONG BIO provides custom synthesis services for AB00670913-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.