2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide
TL;DR: 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide (CAS 243455-07-4) is a chemical compound with molecular formula C12H17N3O3S and molecular weight 283.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,3-dimethoxypropanoylamino)-3-phenylthiourea
Also Known As: 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide, 3,3-dimethoxy-N-[(phenylcarbamothioyl)amino]propanamide, 1-(3,3-dimethoxypropanoylamino)-3-phenylthiourea, 1-(3,3-dimethoxypropanoylamino)-3-phenyl-thiourea
| Molecular Formula | C12H17N3O3S |
|---|---|
| Molecular Weight | 283.10 g/mol |
| LogP | 1.0132 |
| Topological Polar Surface Area | 71.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 283.09906 |
| Heavy Atoms | 19 |
| Complexity | 409.94046 |
Chemical Identifiers
| CAS Number | 243455-07-4 |
|---|---|
| SMILES | COC(CC(=O)NNC(=S)NC1=CC=CC=C1)OC |
Product Overview
2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide (CAS 243455-07-4), with molecular formula C12H17N3O3S and molecular weight 283.10 g/mol. IUPAC: 1-(3,3-dimethoxypropanoylamino)-3-phenylthiourea.
Chemical Property Profile of 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide
Property Insights of 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide
The XLogP value of 1.0132 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide. The TPSA of 71.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide. Following Lipinski's Rule of Five, 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-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 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide?
The CAS number of 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide is 243455-07-4.
What is the molecular formula of 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide?
The molecular formula of 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide is C12H17N3O3S.
What is the molecular weight of 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide?
The molecular weight of 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide is 283.10 g/mol.
Where can I buy 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide?
You can request a quote for 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,3-dimethoxypropanoyl)-N-phenyl-1-hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.