3-{[2-(4-chlorophenyl)quinazolin-4-yl]amino}propyl thiophene-2-carboxylate
Chemical Structure Depiction of
3-{[2-(4-chlorophenyl)quinazolin-4-yl]amino}propyl thiophene-2-carboxylate
3-{[2-(4-chlorophenyl)quinazolin-4-yl]amino}propyl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 5695-0827 |
| Compound Name: | 3-{[2-(4-chlorophenyl)quinazolin-4-yl]amino}propyl thiophene-2-carboxylate |
| Molecular Weight: | 423.92 |
| Molecular Formula: | C22 H18 Cl N3 O2 S |
| Smiles: | C(CNc1c2ccccc2nc(c2ccc(cc2)[Cl])n1)COC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8402 |
| logD: | 6.5741 |
| logSw: | -6.5873 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.035 |
| InChI Key: | NDCWJNQSXMXMPR-UHFFFAOYSA-N |