N-(3-bromophenyl)-3-methyl-1,1-dioxo-4-propyl-1,4-dihydro-1lambda~6~,2,4-benzothiadiazine-7-carboxamide
Chemical Structure Depiction of
N-(3-bromophenyl)-3-methyl-1,1-dioxo-4-propyl-1,4-dihydro-1lambda~6~,2,4-benzothiadiazine-7-carboxamide
N-(3-bromophenyl)-3-methyl-1,1-dioxo-4-propyl-1,4-dihydro-1lambda~6~,2,4-benzothiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | J049-0901 |
| Compound Name: | N-(3-bromophenyl)-3-methyl-1,1-dioxo-4-propyl-1,4-dihydro-1lambda~6~,2,4-benzothiadiazine-7-carboxamide |
| Molecular Weight: | 436.33 |
| Molecular Formula: | C18 H18 Br N3 O3 S |
| Smiles: | CCCN1C(C)=NS(c2cc(ccc12)C(Nc1cccc(c1)[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8328 |
| logD: | 3.8077 |
| logSw: | -3.9323 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.669 |
| InChI Key: | VHGCHMDXUSPTGI-UHFFFAOYSA-N |