Chemical ID: 4937614

c1ccc(c(c1)C(=O)NCCCNC(=O)c2ccccc2O)O
Chemical ID:
4937614
Name [?]:
2-hydroxy-N-[3-(2-hydroxybenzoyl)aminopropyl]benzamide
SMILES [?]:
c1ccc(c(c1)C(=O)NCCCNC(=O)c2ccccc2O)O
InChi [?]:
InChI=1/C17H18N2O4/c20-14-8-3-1-6-12(14)16(22)18-10-5-11-19-17(23)13-7-2-4-9-15(13)21/h1-4,6-9,20-21H,5,10-11H2,(H,18,22)(H,19,23)
InChi Info:
AuxInfo=1/1/N:1,18,2,19,11,6,17,3,20,10,12,5,16,4,21,7,14,9,13,23,22,8,15/E:(1,2)(3,4)(6,7)(8,9)(10,11)(12,13)(14,15)(16,17)(18,19)(20,21)(22,23)/gE:(1,2)/rA:23nCCCCCCCONCCCNCOCCCCCCOO/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;s10;s11;s12;s13;d14;s14;s16;d17;s18;d19;d16s20;s21;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18N2O4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.10414
Area:545.027
Solvation:-5.52154
Coulombic:-75.1298
Bond Count [?]
All:24
Single:16
Double:8
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:314.336
H-Bond Donors:4
H-Bond Acceptors:6
XLogP:3.05
LogP (Chemaxon):2.49

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Descriptor Annotations

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