[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1,5-dimethyl-1H-pyrrol-2-yl](4-methylpiperidin-1-yl)methanone
Chemical Structure Depiction of
[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1,5-dimethyl-1H-pyrrol-2-yl](4-methylpiperidin-1-yl)methanone
[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1,5-dimethyl-1H-pyrrol-2-yl](4-methylpiperidin-1-yl)methanone
Compound characteristics
| Compound ID: | F638-0872 |
| Compound Name: | [4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1,5-dimethyl-1H-pyrrol-2-yl](4-methylpiperidin-1-yl)methanone |
| Molecular Weight: | 415.55 |
| Molecular Formula: | C22 H29 N3 O3 S |
| Smiles: | CC1CCN(CC1)C(c1cc(c(C)n1C)S(N1CCc2ccccc2C1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1153 |
| logD: | 3.1153 |
| logSw: | -3.4337 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.292 |
| InChI Key: | JWGHIFARXMQHGL-UHFFFAOYSA-N |