Chemical ID: 4851937

CCN(CC)CCCNC(=O)c1c(c2cc(c(cc2[nH]c1=O)OC)OC)O
Chemical ID:
4851937
Name [?]:
N-(3-diethylaminopropyl)-4-hydroxy-6,7-dimethoxy-2-oxo-1H-quinoline-3-carboxamide
SMILES [?]:
CCN(CC)CCCNC(=O)c1c(c2cc(c(cc2[nH]c1=O)OC)OC)O
InChi [?]:
InChI=1/C19H27N3O5/c1-5-22(6-2)9-7-8-20-18(24)16-17(23)12-10-14(26-3)15(27-4)11-13(12)21-19(16)25/h10-11H,5-9H2,1-4H3,(H,20,24)(H2,21,23,25)
InChi Info:
AuxInfo=1/1/N:1,5,26,24,2,4,7,8,6,15,18,14,19,16,17,12,13,10,21,9,20,3,27,11,22,25,23/E:(1,2)(5,6)/rA:27nCCNCCCCCNCOCCCCCCCCNCOOCOCO/rB:s1;s2;s3;s4;s3;s6;s7;s8;s9;d10;s10;d12;s13;s14;d15;s16;d17;d14s18;s19;s12s20;d21;s17;s23;s16;s25;s13;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H27N3O5
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:8.66844
Area:621.475
Solvation:-6.86845
Coulombic:-75.0703
Bond Count [?]
All:28
Single:22
Double:6
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:377.435
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:1.53
LogP (Chemaxon):-1.34

Name Annotations

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Descriptor Annotations

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