Chemical ID: 5447680

CCC(CO)N(CC(=O)Nc1cccc(c1C)Cl)CC(=O)Nc2cccc(c2C)Cl
Chemical ID:
5447680
Name [?]:
N-(3-chloro-2-methyl-phenyl)-2-[(3-chloro-2-methyl-phenyl)carbamoylmethyl-[1-(hydroxymethyl)propyl]amino]-acetamide
SMILES [?]:
CCC(CO)N(CC(=O)Nc1cccc(c1C)Cl)CC(=O)Nc2cccc(c2C)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H27Cl2N3O3
All Atoms:30
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:10.0905
Area:665.011
Solvation:-6.5348
Coulombic:-61.4126
Bond Count [?]
All:31
Single:23
Double:8
Rotors:11
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:452.374
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:3.34
LogP (Chemaxon):3.43

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Experimental Annotations

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Descriptor Annotations

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