5-{[3-(methoxycarbonyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-5-oxopentanoic acid
Chemical Structure Depiction of
5-{[3-(methoxycarbonyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-5-oxopentanoic acid
5-{[3-(methoxycarbonyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-5-oxopentanoic acid
Compound characteristics
| Compound ID: | 6049-1118 |
| Compound Name: | 5-{[3-(methoxycarbonyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-5-oxopentanoic acid |
| Molecular Weight: | 339.41 |
| Molecular Formula: | C16 H21 N O5 S |
| Smiles: | CC1CCc2c(C(=O)OC)c(NC(CCCC(O)=O)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9736 |
| logD: | -0.6236 |
| logSw: | -2.3703 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.66 |
| InChI Key: | YCLHIPIWFPRLJM-SECBINFHSA-N |