5-amino-4-(1,3-benzothiazol-2-yl)-1-({1-[(4-methylphenyl)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-methylphenyl)methyl]piperidin-4-yl}methyl)-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1,3-benzothiazol-2-yl)-1-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | F187-0213 |
| Compound Name: | 5-amino-4-(1,3-benzothiazol-2-yl)-1-({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 432.59 |
| Molecular Formula: | C25 H28 N4 O S |
| Smiles: | Cc1ccc(CN2CCC(CC2)CN2CC(C(=C2N)c2nc3ccccc3s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4014 |
| logD: | 1.9221 |
| logSw: | -4.3739 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.598 |
| InChI Key: | IBIOQRHORJXCQJ-UHFFFAOYSA-N |