2-{[3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
2-{[3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}cyclohexane-1-carboxylic acid
2-{[3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y205-7832 |
| Compound Name: | 2-{[3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}cyclohexane-1-carboxylic acid |
| Molecular Weight: | 420.53 |
| Molecular Formula: | C21 H28 N2 O5 S |
| Smiles: | C1CCC(C(C1)C(O)=O)C(Nc1c(C(N2CCOCC2)=O)c2CCCCc2s1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3155 |
| logD: | -0.3352 |
| logSw: | -2.892 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.202 |
| InChI Key: | NBOUAFWGZWAPKT-UHFFFAOYSA-N |