3-[(4-ethyl-5-methyl-3-{[(pyridin-3-yl)methyl]carbamoyl}thiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Chemical Structure Depiction of
3-[(4-ethyl-5-methyl-3-{[(pyridin-3-yl)methyl]carbamoyl}thiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
3-[(4-ethyl-5-methyl-3-{[(pyridin-3-yl)methyl]carbamoyl}thiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Compound characteristics
| Compound ID: | Y205-8073 |
| Compound Name: | 3-[(4-ethyl-5-methyl-3-{[(pyridin-3-yl)methyl]carbamoyl}thiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C23 H25 N3 O4 S |
| Smiles: | CCc1c(C(NCc2cccnc2)=O)c(NC(C2C3CC(C=C3)C2C(O)=O)=O)sc1C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6124 |
| logD: | -0.0097 |
| logSw: | -2.6638 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.308 |
| InChI Key: | QGTZLUDNVXNPKI-UHFFFAOYSA-N |