N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide
TL;DR: N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide (CAS 438233-38-6) is a chemical compound with molecular formula C10H16N4O2S and molecular weight 256.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(5-methyl-1,2-oxazole-3-carbonyl)amino]-3-(2-methylpropyl)thiourea
Also Known As: 1-[(5-methyl-1,2-oxazole-3-carbonyl)amino]-3-(2-methylpropyl)thiourea, N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide, (5-methylisoxazol-3-yl)-N-({[(2-methylpropyl)amino]thioxomethyl}amino)carboxam ide, 2-[(5-methyl-1,2-oxazol-3-yl)carbonyl]-N-(2-methylpropyl)hydrazinecarbothioamide
| Molecular Formula | C10H16N4O2S |
|---|---|
| Molecular Weight | 256.10 g/mol |
| LogP | 0.74792 |
| Topological Polar Surface Area | 79.19 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.0994 |
| Heavy Atoms | 17 |
| Complexity | 402.76508 |
Chemical Identifiers
| CAS Number | 438233-38-6 |
|---|---|
| SMILES | CC1=CC(=NO1)C(=O)NNC(=S)NCC(C)C |
Product Overview
N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide (CAS 438233-38-6), with molecular formula C10H16N4O2S and molecular weight 256.10 g/mol. IUPAC: 1-[(5-methyl-1,2-oxazole-3-carbonyl)amino]-3-(2-methylpropyl)thiourea.
Chemical Property Profile of N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide
Property Insights of N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide
The XLogP value of 0.74792 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide. The TPSA of 79.19 Ų falls within the moderate polarity range, balancing permeability and solubility for N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide. Following Lipinski's Rule of Five, N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide has 3 hydrogen bond donor(s) and 4 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-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide?
The CAS number of N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide is 438233-38-6.
What is the molecular formula of N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide?
The molecular formula of N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide is C10H16N4O2S.
What is the molecular weight of N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide?
The molecular weight of N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide is 256.10 g/mol.
Where can I buy N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide?
You can request a quote for N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-isobutyl-2-[(5-methyl-3-isoxazolyl)carbonyl]hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.