N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide
TL;DR: N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide (CAS 333436-13-8) 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-[(2-butoxybenzoyl)amino]-3-prop-2-enylthiourea
Also Known As: BAS 01580286, N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide, 1-[(2-butoxybenzoyl)amino]-3-prop-2-enylthiourea, (2-butoxyphenyl)-N-{[(prop-2-enylamino)thioxomethyl]amino}carboxamide
| Molecular Formula | C15H21N3O2S |
|---|---|
| Molecular Weight | 307.14 g/mol |
| LogP | 2.1604 |
| Topological Polar Surface Area | 62.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 307.13544 |
| Heavy Atoms | 21 |
| Complexity | 491.562 |
Chemical Identifiers
| CAS Number | 333436-13-8 |
|---|---|
| SMILES | CCCCOC1=CC=CC=C1C(=O)NNC(=S)NCC=C |
Product Overview
N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide (CAS 333436-13-8), with molecular formula C15H21N3O2S and molecular weight 307.14 g/mol. IUPAC: 1-[(2-butoxybenzoyl)amino]-3-prop-2-enylthiourea.
Chemical Property Profile of N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide
Property Insights of N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide
The XLogP value of 2.1604 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide. The TPSA of 62.39 Ų falls within the moderate polarity range, balancing permeability and solubility for N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide. Following Lipinski's Rule of Five, N-allyl-2-(2-butoxybenzoyl)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-(2-butoxybenzoyl)hydrazinecarbothioamide?
The CAS number of N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide is 333436-13-8.
What is the molecular formula of N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide?
The molecular formula of N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide is C15H21N3O2S.
What is the molecular weight of N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide?
The molecular weight of N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide is 307.14 g/mol.
Where can I buy N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide?
You can request a quote for N-allyl-2-(2-butoxybenzoyl)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-(2-butoxybenzoyl)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-2-(2-butoxybenzoyl)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.