3-[2-(4-chlorophenyl)-2-oxoethyl]-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[2-(4-chlorophenyl)-2-oxoethyl]-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4(3H)-one
3-[2-(4-chlorophenyl)-2-oxoethyl]-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F081-1399 |
| Compound Name: | 3-[2-(4-chlorophenyl)-2-oxoethyl]-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 423.85 |
| Molecular Formula: | C22 H18 Cl N3 O4 |
| Smiles: | CC1(C)Cc2c(CO1)cc1c3c(C(N(CC(c4ccc(cc4)[Cl])=O)C=N3)=O)oc1n2 |
| Stereo: | ACHIRAL |
| logP: | 3.2587 |
| logD: | 3.2587 |
| logSw: | -3.6564 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.389 |
| InChI Key: | NNHUHCHQACAOEY-UHFFFAOYSA-N |