1-[(3-methoxyphenyl)methyl]-7-methyl-3-(pyrrolidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
Chemical Structure Depiction of
1-[(3-methoxyphenyl)methyl]-7-methyl-3-(pyrrolidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
1-[(3-methoxyphenyl)methyl]-7-methyl-3-(pyrrolidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
Compound characteristics
| Compound ID: | M786-3295 |
| Compound Name: | 1-[(3-methoxyphenyl)methyl]-7-methyl-3-(pyrrolidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C21 H23 N3 O4 S |
| Smiles: | Cc1ccc2c(c1)N(Cc1cccc(c1)OC)N=C(C(N1CCCC1)=O)S2(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9985 |
| logD: | 2.9985 |
| logSw: | -3.4378 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.247 |
| InChI Key: | WCKSQKRXQBTTDY-UHFFFAOYSA-N |