ethyl (2'H,6'H-spiro[cyclohexane-1,7'-[1,3]dioxolo[4,5-g]isoquinolin]-5'(8'H)-ylidene)acetate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl (2'H,6'H-spiro[cyclohexane-1,7'-[1,3]dioxolo[4,5-g]isoquinolin]-5'(8'H)-ylidene)acetate--hydrogen chloride (1/1)
ethyl (2'H,6'H-spiro[cyclohexane-1,7'-[1,3]dioxolo[4,5-g]isoquinolin]-5'(8'H)-ylidene)acetate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8012-0178 |
| Compound Name: | ethyl (2'H,6'H-spiro[cyclohexane-1,7'-[1,3]dioxolo[4,5-g]isoquinolin]-5'(8'H)-ylidene)acetate--hydrogen chloride (1/1) |
| Molecular Weight: | 365.86 |
| Molecular Formula: | C19 H23 N O4 |
| Salt: | HCl |
| Smiles: | CCOC(\C=C1/c2cc3c(cc2CC2(CCCCC2)N1)OCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3618 |
| logD: | 4.3617 |
| logSw: | -4.2475 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.254 |
| InChI Key: | XMCZTNDCQATIMD-XNTDXEJSSA-N |