propan-2-yl 5-(diethylcarbamoyl)-4-methyl-2-[(9H-xanthene-9-carbonyl)amino]thiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 5-(diethylcarbamoyl)-4-methyl-2-[(9H-xanthene-9-carbonyl)amino]thiophene-3-carboxylate
propan-2-yl 5-(diethylcarbamoyl)-4-methyl-2-[(9H-xanthene-9-carbonyl)amino]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6048-0199 |
| Compound Name: | propan-2-yl 5-(diethylcarbamoyl)-4-methyl-2-[(9H-xanthene-9-carbonyl)amino]thiophene-3-carboxylate |
| Molecular Weight: | 506.62 |
| Molecular Formula: | C28 H30 N2 O5 S |
| Smiles: | CCN(CC)C(c1c(C)c(C(=O)OC(C)C)c(NC(C2c3ccccc3Oc3ccccc23)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0153 |
| logD: | -1.4553 |
| logSw: | -4.7865 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.302 |
| InChI Key: | HGLNLQQZOCAPIE-UHFFFAOYSA-N |