Chemical ID: 4815311

CCC1C(C(c2ccccc2N1C(=O)c3ccc(cc3)Br)Nc4ccccc4)C
Chemical ID:
4815311
Name [?]:
(4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-bromophenyl)-methanone
SMILES [?]:
CCC1C(C(c2ccccc2N1C(=O)c3ccc(cc3)Br)Nc4ccccc4)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H25BrN2O
All Atoms:29
Heavy Atoms:29
Chiral Atoms:3
ZAP Information [?]
Total:12.5943
Area:592.36
Solvation:-2.21465
Coulombic:-33.2747
Bond Count [?]
All:32
Single:22
Double:10
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:449.383
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:6.65
LogP (Chemaxon):6.34

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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