2-methyl-7-(morpholine-4-sulfonyl)-9-nitro-5H-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one
Chemical Structure Depiction of
2-methyl-7-(morpholine-4-sulfonyl)-9-nitro-5H-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one
2-methyl-7-(morpholine-4-sulfonyl)-9-nitro-5H-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one
Compound characteristics
| Compound ID: | 8017-9255 |
| Compound Name: | 2-methyl-7-(morpholine-4-sulfonyl)-9-nitro-5H-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one |
| Molecular Weight: | 411.41 |
| Molecular Formula: | C14 H13 N5 O6 S2 |
| Smiles: | CC1=NN2C(=NC(c3cc(cc(c23)[N+]([O-])=O)S(N2CCOCC2)(=O)=O)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 1.5913 |
| logD: | 1.5913 |
| logSw: | -2.2957 |
| Hydrogen bond acceptors count: | 15 |
| Polar surface area: | 110.57 |
| InChI Key: | LYKPHEMBJVQDMM-UHFFFAOYSA-N |