N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide
TL;DR: N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide (CAS 774189-57-0) is a chemical compound with molecular formula C15H21N3O2S and molecular weight 307.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[4-(2-methylpropoxy)benzoyl]amino]-3-prop-2-enylthiourea
Also Known As: N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide, 1-allyl-3-[(4-isobutoxybenzoyl)amino]thiourea, 1-[[4-(2-methylpropoxy)benzoyl]amino]-3-prop-2-enylthiourea, 1-[[[4-(2-methylpropoxy)phenyl]-oxomethyl]amino]-3-prop-2-enylthiourea, 1-[[4-(2-methylpropoxy)phenyl]carbonylamino]-3-prop-2-enyl-thiourea
| Molecular Formula | C15H21N3O2S |
|---|---|
| Molecular Weight | 307.14 g/mol |
| LogP | 2.0163 |
| Topological Polar Surface Area | 62.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 307.13544 |
| Heavy Atoms | 21 |
| Complexity | 486.19702 |
Chemical Identifiers
| CAS Number | 774189-57-0 |
|---|---|
| SMILES | CC(C)COC1=CC=C(C=C1)C(=O)NNC(=S)NCC=C |
Product Overview
N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide (CAS 774189-57-0), with molecular formula C15H21N3O2S and molecular weight 307.14 g/mol. IUPAC: 1-[[4-(2-methylpropoxy)benzoyl]amino]-3-prop-2-enylthiourea.
Chemical Property Profile of N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide
Property Insights of N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide
The XLogP value of 2.0163 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide. The TPSA of 62.39 Ų falls within the moderate polarity range, balancing permeability and solubility for N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide. Following Lipinski's Rule of Five, N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide 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
Frequently Asked Questions
What is the CAS number of N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide?
The CAS number of N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide is 774189-57-0.
What is the molecular formula of N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide?
The molecular formula of N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide is C15H21N3O2S.
What is the molecular weight of N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide?
The molecular weight of N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide is 307.14 g/mol.
Where can I buy N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide?
You can request a quote for N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-2-(4-isobutoxybenzoyl)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.