Chemical ID: 4214525

c1ccc(cc1)NNC(=O)c2c(c3ccccc3oc2=O)O
Chemical ID:
4214525
Name [?]:
4-hydroxy-2-oxo-N'-phenyl-chromene-3-carbohydrazide
SMILES [?]:
c1ccc(cc1)NNC(=O)c2c(c3ccccc3oc2=O)O
InChi [?]:
InChI=1/C16H12N2O4/c19-14-11-8-4-5-9-12(11)22-16(21)13(14)15(20)18-17-10-6-2-1-3-7-10/h1-9,17,19H,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,2,6,15,16,3,5,14,17,4,13,18,11,12,9,20,7,8,22,10,21,19/E:(2,3)(6,7)/rA:22nCCCCCCNNCOCCCCCCCCOCOO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;d11;s12;s13;d14;s15;d16;d13s17;s18;s11s19;d20;s12;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H12N2O4
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.25793
Area:490.711
Solvation:-4.00983
Coulombic:-62.0013
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:3.39
LogP (Chemaxon):3.69

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Descriptor Annotations

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