AB01333239-02
TL;DR: AB01333239-02 (CAS 1612768-73-6) is a chemical compound with molecular formula C18H17N3O2S and molecular weight 339.10416 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-[[(3-methylbenzoyl)amino]carbamothioyl]-3-phenylprop-2-enamide
Also Known As: AB01333239-02, N-{[2-(3-methylbenzoyl)hydrazino]carbonothioyl}-3-phenylacrylamide, (E)-N-[[(3-methylbenzoyl)amino]carbamothioyl]-3-phenylprop-2-enamide, (2E)-N-({2-[(3-methylphenyl)carbonyl]hydrazinyl}carbonothioyl)-3-phenylprop-2-enamide
Technical Specifications
| Molecular Formula | C18H17N3O2S |
| Molecular Weight | 339.10416 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.10416 Da |
| Heavy Atoms | 24 |
| Complexity | 487.0 |
| SMILES | CC1=CC(=CC=C1)C(=O)NNC(=S)NC(=O)/C=C/C2=CC=CC=C2 |
| InChIKey | NWFBMLGMNFGXKF-ZHACJKMWSA-N |
Chemical Property Profile of AB01333239-02
Property Insights of AB01333239-02
The XLogP value of 3.9 indicates that AB01333239-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01333239-02. Following Lipinski's Rule of Five, AB01333239-02 has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of AB01333239-02?
The CAS number of AB01333239-02 is 1612768-73-6.
What is the molecular formula of AB01333239-02?
The molecular formula of AB01333239-02 is C18H17N3O2S.
What is the molecular weight of AB01333239-02?
The molecular weight of AB01333239-02 is 339.10416 g/mol.
Where can I buy AB01333239-02?
You can request a quote for AB01333239-02 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AB01333239-02?
Yes, CoreyChem provides custom synthesis services for AB01333239-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.