Chemical ID: 5672395

C1CCc2c(c(c(c(n2)O)C(=O)NCCCN3CCOCC3)O)C1
Chemical ID:
5672395
Name [?]:
2,4-dihydroxy-N-(3-morpholinopropyl)-5,6,7,8-tetrahydroquinoline-3-carboxamide
SMILES [?]:
C1CCc2c(c(c(c(n2)O)C(=O)NCCCN3CCOCC3)O)C1
InChi [?]:
InChI=1/C17H25N3O4/c21-15-12-4-1-2-5-13(12)19-17(23)14(15)16(22)18-6-3-7-20-8-10-24-11-9-20/h1-11H2,(H,18,22)(H2,19,21,23)
InChi Info:
AuxInfo=1/1/N:1,2,15,24,3,14,16,18,22,19,21,5,4,7,6,11,8,13,9,17,23,12,10,20/E:(8,9)(10,11)/rA:24nCCCCCCCCNOCONCCCNCCOCCOC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s8;s7;d11;s11;s13;s14;s15;s16;s17;s18;s19;s20;s17s21;s6;s1s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H25N3O4
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:8.64564
Area:548.099
Solvation:-5.05684
Coulombic:-71.2752
Bond Count [?]
All:26
Single:22
Double:4
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:335.398
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:1.46
LogP (Chemaxon):0.85

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