methyl 4-ethyl-5-methyl-2-[(9H-xanthene-9-carbonyl)amino]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 4-ethyl-5-methyl-2-[(9H-xanthene-9-carbonyl)amino]thiophene-3-carboxylate
methyl 4-ethyl-5-methyl-2-[(9H-xanthene-9-carbonyl)amino]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6048-0229 |
| Compound Name: | methyl 4-ethyl-5-methyl-2-[(9H-xanthene-9-carbonyl)amino]thiophene-3-carboxylate |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C23 H21 N O4 S |
| Smiles: | CCc1c(C(=O)OC)c(NC(C2c3ccccc3Oc3ccccc23)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 5.0083 |
| logD: | -1.4622 |
| logSw: | -4.8847 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.111 |
| InChI Key: | XSKRNHLSJOSCNQ-UHFFFAOYSA-N |