2-({7-[2-(cyclohex-1-en-1-yl)ethyl]-8-oxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-6-yl}sulfanyl)-N-(2-methoxyphenyl)butanamide
Chemical Structure Depiction of
2-({7-[2-(cyclohex-1-en-1-yl)ethyl]-8-oxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-6-yl}sulfanyl)-N-(2-methoxyphenyl)butanamide
2-({7-[2-(cyclohex-1-en-1-yl)ethyl]-8-oxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-6-yl}sulfanyl)-N-(2-methoxyphenyl)butanamide
Compound characteristics
| Compound ID: | K284-5070 |
| Compound Name: | 2-({7-[2-(cyclohex-1-en-1-yl)ethyl]-8-oxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-6-yl}sulfanyl)-N-(2-methoxyphenyl)butanamide |
| Molecular Weight: | 521.64 |
| Molecular Formula: | C28 H31 N3 O5 S |
| Smiles: | CCC(C(Nc1ccccc1OC)=O)SC1=Nc2cc3c(cc2C(N1CCC1CCCCC=1)=O)OCO3 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1507 |
| logD: | 6.1506 |
| logSw: | -5.4091 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.352 |
| InChI Key: | MUAQZAGODSYJKE-VWLOTQADSA-N |