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1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea
TL;DR: 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea (CAS 301202-66-4) is a chemical compound with molecular formula C12H17N3O2S and molecular weight 267.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dimethoxyphenyl)methylideneamino]-3-ethylthiourea
Also Known As: 3,4-DIMETHOXYBENZALDEHYDE N-ETHYLTHIOSEMICARBAZONE, 1-[(3,4-dimethoxyphenyl)methylideneamino]-3-ethylthiourea
| Molecular Formula | C12H17N3O2S |
|---|---|
| Molecular Weight | 267.10 g/mol |
| LogP | 1.5217 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 267.10416 |
| Heavy Atoms | 18 |
| Complexity | 435.33075 |
Chemical Identifiers
| CAS Number | 301202-66-4 |
|---|---|
| SMILES | CCNC(=S)NN=CC1=CC(=C(C=C1)OC)OC |
Product Overview
1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea (CAS 301202-66-4), with molecular formula C12H17N3O2S and molecular weight 267.10 g/mol. IUPAC: 1-[(3,4-dimethoxyphenyl)methylideneamino]-3-ethylthiourea.
Chemical Property Profile of 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea
Property Insights of 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea
The XLogP value of 1.5217 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea. With a topological polar surface area (TPSA) of 54.88 Ų, 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea has 2 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 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea?
The CAS number of 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea is 301202-66-4.
What is the molecular formula of 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea?
The molecular formula of 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea is C12H17N3O2S.
What is the molecular weight of 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea?
The molecular weight of 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea is 267.10 g/mol.
Where can I buy 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea?
You can request a quote for 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(3,4-Dimethoxyphenyl)methylideneamino]-3-ethylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.