2-amino-8,8-dimethyl-3-nitro-8,9-dihydropyrazolo[1,5-a]quinazolin-6(7H)-one
Chemical Structure Depiction of
2-amino-8,8-dimethyl-3-nitro-8,9-dihydropyrazolo[1,5-a]quinazolin-6(7H)-one
2-amino-8,8-dimethyl-3-nitro-8,9-dihydropyrazolo[1,5-a]quinazolin-6(7H)-one
Compound characteristics
| Compound ID: | 8014-2290 |
| Compound Name: | 2-amino-8,8-dimethyl-3-nitro-8,9-dihydropyrazolo[1,5-a]quinazolin-6(7H)-one |
| Molecular Weight: | 275.26 |
| Molecular Formula: | C12 H13 N5 O3 |
| Smiles: | CC1(C)CC2=C(C=Nc3c(c(N)nn23)[N+]([O-])=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8758 |
| logD: | 0.8758 |
| logSw: | -1.1136 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.902 |
| InChI Key: | IBCGZZCVODLBBJ-UHFFFAOYSA-N |