Chemical ID: 3930697

c1ccc2c(c1)c(=O)[nH]c(n2)CN(C3CCCC3)C(=O)Nc4cccc(c4)Cl
Chemical ID:
3930697
Name [?]:
3-(3-chlorophenyl)-1-cyclopentyl-1-[(4-oxo-3H-quinazolin-2-yl)methyl]urea
SMILES [?]:
c1ccc2c(c1)c(=O)[nH]c(n2)CN(C3CCCC3)C(=O)Nc4cccc(c4)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H21ClN4O2
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:12.0934
Area:600.694
Solvation:-2.92398
Coulombic:-58.4039
Bond Count [?]
All:31
Single:22
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:396.87
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.33
LogP (Chemaxon):3.94

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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