Chemical ID: 6490305

CC(C(=O)NN=Cc1cccc(c1)Cl)Oc2cccc3c2cccc3
Chemical ID:
6490305
Name [?]:
N-[(3-chlorophenyl)methyleneamino]-2-(1-naphthyloxy)propanamide
SMILES [?]:
CC(C(=O)NN=Cc1cccc(c1)Cl)Oc2cccc3c2cccc3
InChi [?]:
InChI=1/C20H17ClN2O2/c1-14(20(24)23-22-13-15-6-4-9-17(21)12-15)25-19-11-5-8-16-7-2-3-10-18(16)19/h2-14H,1H3,(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,24,23,10,18,9,25,19,11,22,17,13,7,2,8,20,12,21,16,3,14,6,5,4,15/rA:25cCCCONNCCCCCCCClOCCCCCCCCCC/rB:s1;s2;d3;s3;s5;w6;s7;s8;d9;s10;d11;d8s12;s12;s2;s15;s16;d17;s18;d19;d16s20;s21;d22;s23;s20d24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H17ClN2O2
All Atoms:25
Heavy Atoms:25
Chiral Atoms:1
ZAP Information [?]
Total:9.10746
Area:567.645
Solvation:-5.08365
Coulombic:-28.9906
Bond Count [?]
All:27
Single:17
Double:10
Rotors:6
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:352.814
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:6.09
LogP (Chemaxon):5.07

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