AB00714484-01
TL;DR: AB00714484-01 (CAS 749214-39-9) is a chemical compound with molecular formula C23H20N4O4S and molecular weight 448.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(7Z)-7-(5-methyl-2-oxo-1H-indol-3-ylidene)-6-oxo-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-3-yl]benzoate
Also Known As: AB00714484-01, (Z)-ethyl 4-(7-(5-methyl-2-oxoindolin-3-ylidene)-6-oxo-6,7-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl)benzoate, ethyl 4-[(7Z)-7-(5-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl]benzoate, ethyl 4-[(7Z)-7-(5-methyl-2-oxo-1H-indol-3-ylidene)-6-oxo-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-3-yl]benzoate
| Molecular Formula | C23H20N4O4S |
|---|---|
| Molecular Weight | 448.12 g/mol |
| LogP | 1.60082 |
| Topological Polar Surface Area | 93.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 448.1205 |
| Heavy Atoms | 32 |
| Complexity | 1436.105 |
Chemical Identifiers
| CAS Number | 749214-39-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2CN=C3N(C2)C(=O)/C(=C/4\C5=C(C=CC(=C5)C)NC4=O)/S3 |
Product Overview
AB00714484-01 (CAS 749214-39-9), with molecular formula C23H20N4O4S and molecular weight 448.12 g/mol. IUPAC: ethyl 4-[(7Z)-7-(5-methyl-2-oxo-1H-indol-3-ylidene)-6-oxo-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-3-yl]benzoate.
Chemical Property Profile of AB00714484-01
Property Insights of AB00714484-01
The XLogP value of 1.60082 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00714484-01. The TPSA of 93.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00714484-01. Following Lipinski's Rule of Five, AB00714484-01 has 1 hydrogen bond donor(s) and 7 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 AB00714484-01?
The CAS number of AB00714484-01 is 749214-39-9.
What is the molecular formula of AB00714484-01?
The molecular formula of AB00714484-01 is C23H20N4O4S.
What is the molecular weight of AB00714484-01?
The molecular weight of AB00714484-01 is 448.12 g/mol.
Where can I buy AB00714484-01?
You can request a quote for AB00714484-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00714484-01?
Yes, KEHONG BIO provides custom synthesis services for AB00714484-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.