ethyl 3-(2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 3-(2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}acetamido)benzoate
ethyl 3-(2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | F409-0035 |
| Compound Name: | ethyl 3-(2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 478.57 |
| Molecular Formula: | C19 H18 N4 O5 S3 |
| Smiles: | CCOC(c1cccc(c1)NC(CSc1ncc(c(N)n1)S(c1cccs1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0384 |
| logD: | 3.0384 |
| logSw: | -3.4025 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 112.901 |
| InChI Key: | FYHNEOWLZMRKRT-UHFFFAOYSA-N |