2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide
TL;DR: 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide (CAS 339022-29-6) is a chemical compound with molecular formula C13H13N3O2S2 and molecular weight 307.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3-phenylmethoxythiophene-2-carbonyl)amino]thiourea
Also Known As: 2-{[3-(benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide, 3-(benzyloxy)-N-(carbamothioylamino)thiophene-2-carboxamide, [(3-phenylmethoxythiophene-2-carbonyl)amino]thiourea, [(3-benzyloxythiophene-2-carbonyl)amino]thiourea, 2-{3-(Benzyloxy)-2-thienylcarbonyl}-1-hydrazinecarbothioamide
| Molecular Formula | C13H13N3O2S2 |
|---|---|
| Molecular Weight | 307.04 g/mol |
| LogP | 1.8051 |
| Topological Polar Surface Area | 76.38 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.04492 |
| Heavy Atoms | 20 |
| Complexity | 598.6736 |
Chemical Identifiers
| CAS Number | 339022-29-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=C(SC=C2)C(=O)NNC(=S)N |
Product Overview
2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide (CAS 339022-29-6), with molecular formula C13H13N3O2S2 and molecular weight 307.04 g/mol. IUPAC: [(3-phenylmethoxythiophene-2-carbonyl)amino]thiourea.
Chemical Property Profile of 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide
Property Insights of 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide
The XLogP value of 1.8051 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide. The TPSA of 76.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide. Following Lipinski's Rule of Five, 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-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-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide?
The CAS number of 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide is 339022-29-6.
What is the molecular formula of 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide?
The molecular formula of 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide is C13H13N3O2S2.
What is the molecular weight of 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide?
The molecular weight of 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide is 307.04 g/mol.
Where can I buy 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide?
You can request a quote for 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-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-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-{[3-(Benzyloxy)-2-thienyl]carbonyl}-1-hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.