TL;DR: 4-Cyclohexylmethyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid (CAS 1012-17-5) is a chemical compound with molecular formula C14H17NO2S and molecular weight 263.098 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(cyclohexylmethyl)thieno[3,2-b]pyrrole-5-carboxylic acid
Also Known As: 4-Cyclohexylmethyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid, ASN 09531513, 4-(cyclohexylmethyl)thieno[3,2-b]pyrrole-5-carboxylic acid, 3-(4-Chloro-phenyl)-2-methyl-propionic acid
| Molecular Formula | C14H17NO2S |
| Molecular Weight | 263.098 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.098 Da |
| Heavy Atoms | 18 |
| Complexity | 317.0 |
| SMILES | C1CCC(CC1)CN2C3=C(C=C2C(=O)O)SC=C3 |
| InChIKey | TUCHVYGTKMISKG-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that 4-Cyclohexylmethyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Cyclohexylmethyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid. Following Lipinski's Rule of Five, 4-Cyclohexylmethyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Cyclohexylmethyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid is 1012-17-5.
The molecular formula of 4-Cyclohexylmethyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid is C14H17NO2S.
The molecular weight of 4-Cyclohexylmethyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid is 263.098 g/mol.
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