Chemical ID: 5901391

CC(c1nc2cc(ccc2c(=O)n1C)Cl)NC(=O)c3cccc(c3)Br
Chemical ID:
5901391
Name [?]:
3-bromo-N-[1-(7-chloro-3-methyl-4-oxo-quinazolin-2-yl)ethyl]benzamide
SMILES [?]:
CC(c1nc2cc(ccc2c(=O)n1C)Cl)NC(=O)c3cccc(c3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H15BrClN3O2
All Atoms:25
Heavy Atoms:25
Chiral Atoms:1
ZAP Information [?]
Total:11.9314
Area:574.231
Solvation:-2.42438
Coulombic:-46.0258
Bond Count [?]
All:27
Single:18
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:420.687
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.91
LogP (Chemaxon):3.67

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Experimental Annotations

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Descriptor Annotations

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