1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea
TL;DR: 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea (CAS 18670-32-1) is a chemical compound with molecular formula C13H25N3O2S and molecular weight 287.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea
Also Known As: NCIOpen2_005508, 1-cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea, 1-cyclohexyl-3-[(E)-4,4-dimethoxybutan-2-ylideneamino]thiour
| Molecular Formula | C13H25N3O2S |
|---|---|
| Molecular Weight | 287.17 g/mol |
| LogP | 2.1681 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 287.16675 |
| Heavy Atoms | 19 |
| Complexity | 300.26346 |
Chemical Identifiers
| CAS Number | 18670-32-1 |
|---|---|
| SMILES | CC(=NNC(=S)NC1CCCCC1)CC(OC)OC |
Product Overview
1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea (CAS 18670-32-1), with molecular formula C13H25N3O2S and molecular weight 287.17 g/mol. IUPAC: 1-cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea.
Chemical Property Profile of 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea
Property Insights of 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea
The XLogP value of 2.1681 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea. With a topological polar surface area (TPSA) of 54.88 Ų, 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea 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-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea?
The CAS number of 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea is 18670-32-1.
What is the molecular formula of 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea?
The molecular formula of 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea is C13H25N3O2S.
What is the molecular weight of 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea?
The molecular weight of 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea is 287.17 g/mol.
Where can I buy 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea?
You can request a quote for 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Cyclohexyl-3-(4,4-dimethoxybutan-2-ylideneamino)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.