Chemical ID: 4807145

CC(C(=O)Nc1c2c(cccc2OC)[nH]c1C(=O)OC)N3CCc4ccccc4C3
Chemical ID:
4807145
Name [?]:
methyl 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propanoylamino]-4-methoxy-1H-indole-2-carboxylate
SMILES [?]:
CC(C(=O)Nc1c2c(cccc2OC)[nH]c1C(=O)OC)N3CCc4ccccc4C3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H25N3O4
All Atoms:30
Heavy Atoms:30
Chiral Atoms:2
ZAP Information [?]
Total:9.62454
Area:595.335
Solvation:-5.25884
Coulombic:-64.3527
Bond Count [?]
All:33
Single:24
Double:9
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:407.462
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.65
LogP (Chemaxon):3.64

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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