Chemical ID: 7264766

CN(CC(=O)Nc1ccccc1Br)C(=O)CCc2ccccc2
Chemical ID:
7264766
Name [?]:
N-[(2-bromophenyl)carbamoylmethyl]-N-methyl-3-phenyl-propanamide
SMILES [?]:
CN(CC(=O)Nc1ccccc1Br)C(=O)CCc2ccccc2
InChi [?]:
InChI=1/C18H19BrN2O2/c1-21(18(23)12-11-14-7-3-2-4-8-14)13-17(22)20-16-10-6-5-9-15(16)19/h2-10H,11-13H2,1H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,21,20,22,10,9,19,23,11,8,17,16,3,18,12,7,4,14,13,6,2,5,15/E:(3,4)(7,8)/rA:23nCNCCONCCCCCCBrCOCCCCCCCC/rB:s1;s2;s3;d4;s4;s6;s7;d8;s9;d10;d7s11;s12;s2;d14;s14;s16;s17;s18;d19;s20;d21;d18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19BrN2O2
All Atoms:42
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.5382
Area:554.101
Solvation:-3.31437
Coulombic:-38.2667
Bond Count [?]
All:24
Single:16
Double:8
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:375.26
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.09
LogP (Chemaxon):2.93

Name Annotations

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Descriptor Annotations

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