1-[(4-fluorophenyl)methyl]-7-methyl-3-(pyrrolidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
Chemical Structure Depiction of
1-[(4-fluorophenyl)methyl]-7-methyl-3-(pyrrolidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
1-[(4-fluorophenyl)methyl]-7-methyl-3-(pyrrolidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
Compound characteristics
| Compound ID: | M786-3305 |
| Compound Name: | 1-[(4-fluorophenyl)methyl]-7-methyl-3-(pyrrolidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C20 H20 F N3 O3 S |
| Smiles: | Cc1ccc2c(c1)N(Cc1ccc(cc1)F)N=C(C(N1CCCC1)=O)S2(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9722 |
| logD: | 2.9722 |
| logSw: | -3.3591 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.704 |
| InChI Key: | BEBLLYSHLPHJKM-UHFFFAOYSA-N |