AB00355192-02
TL;DR: AB00355192-02 (CAS 708251-78-9) is a chemical compound with molecular formula C19H17N3O6S2 and molecular weight 447.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-ethoxycarbonylanilino)-2-oxoethyl]sulfanyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid
Also Known As: AB00355192-02, F1598-0005, 2-((2-((4-(ethoxycarbonyl)phenyl)amino)-2-oxoethyl)thio)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylic acid, 2-[({[4-(ethoxycarbonyl)phenyl]carbamoyl}methyl)sulfanyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylic acid, 2-[2-(4-ethoxycarbonylanilino)-2-oxoethyl]sulfanyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid
| Molecular Formula | C19H17N3O6S2 |
|---|---|
| Molecular Weight | 447.06 g/mol |
| LogP | 2.89872 |
| Topological Polar Surface Area | 138.45 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 447.05588 |
| Heavy Atoms | 30 |
| Complexity | 1183.4382 |
Chemical Identifiers
| CAS Number | 708251-78-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=C(S3)C(=O)O)C)C(=O)N2 |
Product Overview
AB00355192-02 (CAS 708251-78-9), with molecular formula C19H17N3O6S2 and molecular weight 447.06 g/mol. IUPAC: 2-[2-(4-ethoxycarbonylanilino)-2-oxoethyl]sulfanyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid.
Chemical Property Profile of AB00355192-02
Property Insights of AB00355192-02
The XLogP value of 2.89872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00355192-02. The TPSA of 138.45 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00355192-02. Following Lipinski's Rule of Five, AB00355192-02 has 3 hydrogen bond donor(s) and 8 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 AB00355192-02?
The CAS number of AB00355192-02 is 708251-78-9.
What is the molecular formula of AB00355192-02?
The molecular formula of AB00355192-02 is C19H17N3O6S2.
What is the molecular weight of AB00355192-02?
The molecular weight of AB00355192-02 is 447.06 g/mol.
Where can I buy AB00355192-02?
You can request a quote for AB00355192-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00355192-02?
Yes, KEHONG BIO provides custom synthesis services for AB00355192-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.