methyl 3-[(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)amino]thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)amino]thiophene-2-carboxylate
methyl 3-[(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)amino]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | E920-0892 |
| Compound Name: | methyl 3-[(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)amino]thiophene-2-carboxylate |
| Molecular Weight: | 306.34 |
| Molecular Formula: | C14 H14 N2 O4 S |
| Smiles: | COC(c1c(ccs1)NC(c1c2CCCCc2on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4525 |
| logD: | 2.1509 |
| logSw: | -2.8187 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.224 |
| InChI Key: | OMDAKBONCSOONX-UHFFFAOYSA-N |