6,6-dimethyl-9-(thiophen-2-yl)-6,7,9,10-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-b][1,4]benzodiazepin-8(5H)-one
Chemical Structure Depiction of
6,6-dimethyl-9-(thiophen-2-yl)-6,7,9,10-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-b][1,4]benzodiazepin-8(5H)-one
6,6-dimethyl-9-(thiophen-2-yl)-6,7,9,10-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-b][1,4]benzodiazepin-8(5H)-one
Compound characteristics
| Compound ID: | 8018-0827 |
| Compound Name: | 6,6-dimethyl-9-(thiophen-2-yl)-6,7,9,10-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-b][1,4]benzodiazepin-8(5H)-one |
| Molecular Weight: | 316.38 |
| Molecular Formula: | C15 H16 N4 O2 S |
| Smiles: | CC1(C)CC2=C(C(c3cccs3)Nc3c(N2)non3)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9818 |
| logD: | 0.6898 |
| logSw: | -3.3342 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.536 |
| InChI Key: | PZDIBCCRARWWFI-LBPRGKRZSA-N |