5-amino-4-(1,3-benzothiazol-2-yl)-1-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1,3-benzothiazol-2-yl)-1-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1,3-benzothiazol-2-yl)-1-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | F187-0222 |
| Compound Name: | 5-amino-4-(1,3-benzothiazol-2-yl)-1-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 453.01 |
| Molecular Formula: | C24 H25 Cl N4 O S |
| Smiles: | C1CN(CCC1CN1CC(C(=C1N)c1nc2ccccc2s1)=O)Cc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5727 |
| logD: | 3.1713 |
| logSw: | -4.7999 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.598 |
| InChI Key: | NGDPUMMTSYFVCY-UHFFFAOYSA-N |