TL;DR: 1-(Cyclopropylmethyl)-3-ethylthiourea (CAS 883040-27-5) is a chemical compound with molecular formula C7H14N2S and molecular weight 158.08777 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(cyclopropylmethyl)-3-ethylthiourea
Also Known As: Maybridge4_003210, 1-(cyclopropylmethyl)-3-ethylthiourea, BRD-K12737073-001-01-8
| Molecular Formula | C7H14N2S |
| Molecular Weight | 158.08777 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 56.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 158.08777 Da |
| Heavy Atoms | 10 |
| Complexity | 121.0 |
| SMILES | CCNC(=S)NCC1CC1 |
| InChIKey | IWNFOYILYFRZCM-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Cyclopropylmethyl)-3-ethylthiourea. With a topological polar surface area (TPSA) of 56.2 Ų, 1-(Cyclopropylmethyl)-3-ethylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Cyclopropylmethyl)-3-ethylthiourea has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(Cyclopropylmethyl)-3-ethylthiourea is 883040-27-5.
The molecular formula of 1-(Cyclopropylmethyl)-3-ethylthiourea is C7H14N2S.
The molecular weight of 1-(Cyclopropylmethyl)-3-ethylthiourea is 158.08777 g/mol.
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