N-allyl-2-(phenylacetyl)hydrazinecarbothioamide
TL;DR: N-allyl-2-(phenylacetyl)hydrazinecarbothioamide (CAS 15814-11-6) is a chemical compound with molecular formula C12H15N3OS and molecular weight 249.09358 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2-phenylacetyl)amino]-3-prop-2-enylthiourea
Also Known As: N-allyl-2-(phenylacetyl)hydrazinecarbothioamide, 1-[(2-phenylacetyl)amino]-3-prop-2-enylthiourea, 1-allyl-3-[(2-phenylacetyl)amino]thiourea, 2-PHENYL-N-{[(PROP-2-EN-1-YL)CARBAMOTHIOYL]AMINO}ACETAMIDE, AB01334023-02
Technical Specifications
| Molecular Formula | C12H15N3OS |
| Molecular Weight | 249.09358 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 85.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.09358 Da |
| Heavy Atoms | 17 |
| Complexity | 275.0 |
| SMILES | C=CCNC(=S)NNC(=O)CC1=CC=CC=C1 |
| InChIKey | WIUNQZOKCDTBGU-UHFFFAOYSA-N |
Chemical Property Profile of N-allyl-2-(phenylacetyl)hydrazinecarbothioamide
Property Insights of N-allyl-2-(phenylacetyl)hydrazinecarbothioamide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-allyl-2-(phenylacetyl)hydrazinecarbothioamide. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-allyl-2-(phenylacetyl)hydrazinecarbothioamide. Following Lipinski's Rule of Five, N-allyl-2-(phenylacetyl)hydrazinecarbothioamide has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-allyl-2-(phenylacetyl)hydrazinecarbothioamide?
The CAS number of N-allyl-2-(phenylacetyl)hydrazinecarbothioamide is 15814-11-6.
What is the molecular formula of N-allyl-2-(phenylacetyl)hydrazinecarbothioamide?
The molecular formula of N-allyl-2-(phenylacetyl)hydrazinecarbothioamide is C12H15N3OS.
What is the molecular weight of N-allyl-2-(phenylacetyl)hydrazinecarbothioamide?
The molecular weight of N-allyl-2-(phenylacetyl)hydrazinecarbothioamide is 249.09358 g/mol.
Where can I buy N-allyl-2-(phenylacetyl)hydrazinecarbothioamide?
You can request a quote for N-allyl-2-(phenylacetyl)hydrazinecarbothioamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-allyl-2-(phenylacetyl)hydrazinecarbothioamide?
Yes, CoreyChem provides custom synthesis services for N-allyl-2-(phenylacetyl)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.