methyl 4,5-dimethyl-2-[(9H-xanthene-9-carbonyl)amino]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 4,5-dimethyl-2-[(9H-xanthene-9-carbonyl)amino]thiophene-3-carboxylate
methyl 4,5-dimethyl-2-[(9H-xanthene-9-carbonyl)amino]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6049-1703 |
| Compound Name: | methyl 4,5-dimethyl-2-[(9H-xanthene-9-carbonyl)amino]thiophene-3-carboxylate |
| Molecular Weight: | 393.46 |
| Molecular Formula: | C22 H19 N O4 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(C2c3ccccc3Oc3ccccc23)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 4.5203 |
| logD: | -1.9502 |
| logSw: | -4.6806 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.111 |
| InChI Key: | VNJWDAKRBHNTMQ-UHFFFAOYSA-N |