Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)-
TL;DR: Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)- (CAS 96662-11-2) is a chemical compound with molecular formula C11H15N3S and molecular weight 221.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-(propan-2-ylideneamino)thiourea
Also Known As: acetone-4-benzyl-thiosemicarbazone, 1-benzyl-3-(propan-2-ylideneamino)thiourea, Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)-, N-benzyl-2-(propan-2-ylidene)hydrazinecarbothioamide, N-Benzyl-2-(propan-2-ylidene)hydrazine-1-carbothioamide
| Molecular Formula | C11H15N3S |
|---|---|
| Molecular Weight | 221.10 g/mol |
| LogP | 2.0465 |
| Topological Polar Surface Area | 36.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.09866 |
| Heavy Atoms | 15 |
| Complexity | 342.11047 |
Chemical Identifiers
| CAS Number | 96662-11-2 |
|---|---|
| SMILES | CC(=NNC(=S)NCC1=CC=CC=C1)C |
Product Overview
Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)- (CAS 96662-11-2), with molecular formula C11H15N3S and molecular weight 221.10 g/mol. IUPAC: 1-benzyl-3-(propan-2-ylideneamino)thiourea.
Chemical Property Profile of Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)-
Property Insights of Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)-
The XLogP value of 2.0465 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)-. With a topological polar surface area (TPSA) of 36.42 Ų, Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)- has 2 hydrogen bond donor(s) and 2 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 Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)-?
The CAS number of Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)- is 96662-11-2.
What is the molecular formula of Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)-?
The molecular formula of Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)- is C11H15N3S.
What is the molecular weight of Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)-?
The molecular weight of Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)- is 221.10 g/mol.
Where can I buy Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)-?
You can request a quote for Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Hydrazinecarbothioamide, 2-(1-methylethylidene)-N-(phenylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.