Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate
TL;DR: Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate (CAS 649713-77-9) is a chemical compound with molecular formula C10H11N3O3S2 and molecular weight 285.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]carbamate
Also Known As: methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate, AS-871/41822495, F1618-0617, methyl N-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]carbamate, (E)-methyl 2-((3-(thiophen-2-yl)acryloyl)carbamothioyl)hydrazinecarboxylate
| Molecular Formula | C10H11N3O3S2 |
|---|---|
| Molecular Weight | 285.02 g/mol |
| LogP | 1.023 |
| Topological Polar Surface Area | 79.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.02417 |
| Heavy Atoms | 18 |
| Complexity | 456.94278 |
Chemical Identifiers
| CAS Number | 649713-77-9 |
|---|---|
| SMILES | COC(=O)NNC(=S)NC(=O)/C=C/C1=CC=CS1 |
Product Overview
Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate (CAS 649713-77-9), with molecular formula C10H11N3O3S2 and molecular weight 285.02 g/mol. IUPAC: methyl N-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]carbamate.
Chemical Property Profile of Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate
Property Insights of Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate
The XLogP value of 1.023 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate. The TPSA of 79.46 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate. Following Lipinski's Rule of Five, Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate has 3 hydrogen bond donor(s) and 5 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 Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate?
The CAS number of Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate is 649713-77-9.
What is the molecular formula of Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate?
The molecular formula of Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate is C10H11N3O3S2.
What is the molecular weight of Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate?
The molecular weight of Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate is 285.02 g/mol.
Where can I buy Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate?
You can request a quote for Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-({[3-(2-thienyl)acryloyl]amino}carbothioyl)hydrazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.