Chemical ID: 5496891

c1ccc(cc1)NNC(=O)c2cc3cc(ccc3oc2=O)O
Chemical ID:
5496891
Name [?]:
6-hydroxy-2-oxo-N'-phenyl-chromene-3-carbohydrazide
SMILES [?]:
c1ccc(cc1)NNC(=O)c2cc3cc(ccc3oc2=O)O
InChi [?]:
InChI=1/C16H12N2O4/c19-12-6-7-14-10(8-12)9-13(16(21)22-14)15(20)18-17-11-4-2-1-3-5-11/h1-9,17,19H,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,16,17,14,12,13,4,15,11,18,9,20,7,8,22,10,21,19/E:(2,3)(4,5)/rA:22nCCCCCCNNCOCCCCCCCCOCOO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;d11;s12;s13;d14;s15;d16;d13s17;s18;s11s19;d20;s15;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H12N2O4
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:6.95459
Area:492.648
Solvation:-5.3616
Coulombic:-60.0964
Bond Count [?]
All:24
Single:15
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:296.278
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:2.63
LogP (Chemaxon):2.39

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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