(2-{[3-(methoxycarbonyl)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxoethoxy)acetic acid
Chemical Structure Depiction of
(2-{[3-(methoxycarbonyl)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxoethoxy)acetic acid
(2-{[3-(methoxycarbonyl)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxoethoxy)acetic acid
Compound characteristics
| Compound ID: | Y200-3967 |
| Compound Name: | (2-{[3-(methoxycarbonyl)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxoethoxy)acetic acid |
| Molecular Weight: | 403.45 |
| Molecular Formula: | C20 H21 N O6 S |
| Smiles: | COC(c1c2CCC(Cc2sc1NC(COCC(O)=O)=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8897 |
| logD: | -0.6399 |
| logSw: | -3.3456 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.823 |
| InChI Key: | CHJDTDZDRVWYCF-CYBMUJFWSA-N |