AB00674127-01
TL;DR: AB00674127-01 (CAS 897734-24-6) is a chemical compound with molecular formula C19H18N2O5S2 and molecular weight 418.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-(2-methylbenzoyl)imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate
Also Known As: AB00674127-01, F1366-1147, (Z)-methyl 2-(2-((2-methylbenzoyl)imino)-6-(methylsulfonyl)benzo[d]thiazol-3(2H)-yl)acetate, methyl 2-[(2Z)-6-methanesulfonyl-2-[(2-methylbenzoyl)imino]-2,3-dihydro-1,3-benzothiazol-3-yl]acetate, methyl 2-[2-(2-methylbenzoyl)imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate
| Molecular Formula | C19H18N2O5S2 |
|---|---|
| Molecular Weight | 418.07 g/mol |
| LogP | 2.32882 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 418.0657 |
| Heavy Atoms | 28 |
| Complexity | 1252.8098 |
Chemical Identifiers
| CAS Number | 897734-24-6 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)C)CC(=O)OC |
Product Overview
AB00674127-01 (CAS 897734-24-6), with molecular formula C19H18N2O5S2 and molecular weight 418.07 g/mol. IUPAC: methyl 2-[2-(2-methylbenzoyl)imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate.
Chemical Property Profile of AB00674127-01
Property Insights of AB00674127-01
The XLogP value of 2.32882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00674127-01. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00674127-01. Following Lipinski's Rule of Five, AB00674127-01 has 0 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 AB00674127-01?
The CAS number of AB00674127-01 is 897734-24-6.
What is the molecular formula of AB00674127-01?
The molecular formula of AB00674127-01 is C19H18N2O5S2.
What is the molecular weight of AB00674127-01?
The molecular weight of AB00674127-01 is 418.07 g/mol.
Where can I buy AB00674127-01?
You can request a quote for AB00674127-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00674127-01?
Yes, KEHONG BIO provides custom synthesis services for AB00674127-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.