Chemical ID: 4829363

CCCCN1c2ccccc2C(=NNC(=O)Cc3ccccc3)C1=O
Chemical ID:
4829363
Name [?]:
N-(1-butyl-2-oxo-indolin-3-ylidene)amino-2-phenyl-acetamide
SMILES [?]:
CCCCN1c2ccccc2C(=NNC(=O)Cc3ccccc3)C1=O
InChi [?]:
InChI=1/C20H21N3O2/c1-2-3-13-23-17-12-8-7-11-16(17)19(20(23)25)22-21-18(24)14-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3,(H,21,24)
InChi Info:
AuxInfo=1/1/N:1,2,3,21,20,22,9,8,19,23,10,7,4,17,18,11,6,15,12,24,14,13,5,16,25/E:(5,6)(9,10)/rA:25nCCCCNCCCCCCCNNCOCCCCCCCCO/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s11;w12;s13;s14;d15;s15;s17;s18;d19;s20;d21;d18s22;s5s12;d24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H21N3O2
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.79815
Area:577.715
Solvation:-4.64473
Coulombic:-37.4017
Bond Count [?]
All:27
Single:18
Double:9
Rotors:7
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:335.4
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.16
LogP (Chemaxon):3.73

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