Chemical ID: 5873823

Cc1cccc(c1NC(=O)NCC(=O)N2CCc3cc(c(cc3C2)OC)OC)C
Chemical ID:
5873823
Name [?]:
3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonylmethyl]-1-(2,6-dimethylphenyl)-urea
SMILES [?]:
Cc1cccc(c1NC(=O)NCC(=O)N2CCc3cc(c(cc3C2)OC)OC)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H27N3O4
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:9.22186
Area:633.451
Solvation:-6.61441
Coulombic:-64.3336
Bond Count [?]
All:31
Single:23
Double:8
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:397.468
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:1.8
LogP (Chemaxon):1.4

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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