[7-methyl-3-(morpholine-4-carbonyl)-4,4-dioxo-4lambda~6~,1,2-benzothiadiazin-1(4H)-yl]acetonitrile
Chemical Structure Depiction of
[7-methyl-3-(morpholine-4-carbonyl)-4,4-dioxo-4lambda~6~,1,2-benzothiadiazin-1(4H)-yl]acetonitrile
[7-methyl-3-(morpholine-4-carbonyl)-4,4-dioxo-4lambda~6~,1,2-benzothiadiazin-1(4H)-yl]acetonitrile
Compound characteristics
| Compound ID: | M786-3476 |
| Compound Name: | [7-methyl-3-(morpholine-4-carbonyl)-4,4-dioxo-4lambda~6~,1,2-benzothiadiazin-1(4H)-yl]acetonitrile |
| Molecular Weight: | 348.38 |
| Molecular Formula: | C15 H16 N4 O4 S |
| Smiles: | Cc1ccc2c(c1)N(CC#N)N=C(C(N1CCOCC1)=O)S2(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0919 |
| logD: | 0.0919 |
| logSw: | -2.1805 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 85.988 |
| InChI Key: | BPVVMQJALMADSC-UHFFFAOYSA-N |