AB00672484-01
TL;DR: AB00672484-01 (CAS 394239-72-6) is a chemical compound with molecular formula C24H22F3N7O2S2 and molecular weight 561.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(2,5-dimethylphenyl)-5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-(trifluoromethyl)benzamide
Also Known As: AB00672484-01, F0772-1653, N-((4-(2,5-dimethylphenyl)-5-((2-((5-methyl-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-2-(trifluoromethyl)benzamide, N-{[4-(2,5-dimethylphenyl)-5-({[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-2-(trifluoromethyl)benzamide, N-[[4-(2,5-dimethylphenyl)-5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-(trifluoromethyl)benzamide
| Molecular Formula | C24H22F3N7O2S2 |
|---|---|
| Molecular Weight | 561.12 g/mol |
| LogP | 4.72366 |
| Topological Polar Surface Area | 114.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 561.12286 |
| Heavy Atoms | 38 |
| Complexity | 1483.9225 |
Chemical Identifiers
| CAS Number | 394239-72-6 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)N2C(=NN=C2SCC(=O)NC3=NN=C(S3)C)CNC(=O)C4=CC=CC=C4C(F)(F)F |
Product Overview
AB00672484-01 (CAS 394239-72-6), with molecular formula C24H22F3N7O2S2 and molecular weight 561.12 g/mol. IUPAC: N-[[4-(2,5-dimethylphenyl)-5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-(trifluoromethyl)benzamide.
Chemical Property Profile of AB00672484-01
Property Insights of AB00672484-01
The XLogP value of 4.72366 indicates that AB00672484-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.69 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00672484-01. Following Lipinski's Rule of Five, AB00672484-01 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00672484-01?
The CAS number of AB00672484-01 is 394239-72-6.
What is the molecular formula of AB00672484-01?
The molecular formula of AB00672484-01 is C24H22F3N7O2S2.
What is the molecular weight of AB00672484-01?
The molecular weight of AB00672484-01 is 561.12 g/mol.
Where can I buy AB00672484-01?
You can request a quote for AB00672484-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00672484-01?
Yes, KEHONG BIO provides custom synthesis services for AB00672484-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.