2-amino-9-fluoro[1,3,4]thiadiazolo[3',2':1,2]pyrimido[5,4-b]indol-5(6H)-one
Chemical Structure Depiction of
2-amino-9-fluoro[1,3,4]thiadiazolo[3',2':1,2]pyrimido[5,4-b]indol-5(6H)-one
2-amino-9-fluoro[1,3,4]thiadiazolo[3',2':1,2]pyrimido[5,4-b]indol-5(6H)-one
Compound characteristics
| Compound ID: | 8018-3310 |
| Compound Name: | 2-amino-9-fluoro[1,3,4]thiadiazolo[3',2':1,2]pyrimido[5,4-b]indol-5(6H)-one |
| Molecular Weight: | 275.26 |
| Molecular Formula: | C11 H6 F N5 O S |
| Smiles: | c1cc2c(cc1F)c1c(C(N3C(=N1)SC(N)=N3)=O)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 1.0996 |
| logD: | 0.384 |
| logSw: | -2.3271 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.005 |
| InChI Key: | SMTGWQYSYBLSHU-UHFFFAOYSA-N |