1-[(3-methoxyphenyl)methyl]-3-(pyrrolidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
Chemical Structure Depiction of
1-[(3-methoxyphenyl)methyl]-3-(pyrrolidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
1-[(3-methoxyphenyl)methyl]-3-(pyrrolidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
Compound characteristics
| Compound ID: | M786-2926 |
| Compound Name: | 1-[(3-methoxyphenyl)methyl]-3-(pyrrolidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione |
| Molecular Weight: | 399.47 |
| Molecular Formula: | C20 H21 N3 O4 S |
| Smiles: | COc1cccc(CN2c3ccccc3S(C(C(N3CCCC3)=O)=N2)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.3815 |
| logD: | 2.3815 |
| logSw: | -2.7986 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.247 |
| InChI Key: | UNXGOXBTZNHJAU-UHFFFAOYSA-N |