Chemical ID: 6631777

c1ccc2c(c1)cccc2C(=O)NCC(=O)NN=Cc3ccc(cc3)O
Chemical ID:
6631777
Name [?]:
N-[(4-hydroxyphenyl)methyleneaminocarbamoylmethyl]naphthalene-1-carboxamide
SMILES [?]:
c1ccc2c(c1)cccc2C(=O)NCC(=O)NN=Cc3ccc(cc3)O
InChi [?]:
InChI=1/C20H17N3O3/c24-16-10-8-14(9-11-16)12-22-23-19(25)13-21-20(26)18-7-3-5-15-4-1-2-6-17(15)18/h1-12,24H,13H2,(H,21,26)(H,23,25)
InChi Info:
AuxInfo=1/1/N:1,2,8,6,7,3,9,21,25,22,24,19,14,20,5,23,4,10,15,11,13,18,17,26,16,12/E:(8,9)(10,11)/rA:26nCCCCCCCCCCCONCCONNCCCCCCCO/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;d11;s11;s13;s14;d15;s15;s17;w18;s19;s20;d21;s22;d23;d20s24;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H17N3O3
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:9.38052
Area:570.714
Solvation:-4.88732
Coulombic:-58.1011
Bond Count [?]
All:28
Single:17
Double:11
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:347.367
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:4.03
LogP (Chemaxon):2.88

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