Chemical ID: 5871292

c1ccc(cc1)c2ncc(s2)C=O
Chemical ID:
5871292
Name [?]:
2-phenylthiazole-5-carbaldehyde
SMILES [?]:
c1ccc(cc1)c2ncc(s2)C=O
InChi [?]:
InChI=1/C10H7NOS/c12-7-9-6-11-10(13-9)8-4-2-1-3-5-8/h1-7H
InChi Info:
AuxInfo=1/0/N:1,2,6,3,5,9,12,4,10,7,8,13,11/E:(2,3)(4,5)/rA:13nCCCCCCCNCCSCO/rB:s1;d2;s3;d4;d1s5;s4;d7;s8;d9;s7s10;s10;d12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H7NOS
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.18432
Area:358.293
Solvation:-2.77301
Coulombic:-13.4177
Bond Count [?]
All:14
Single:8
Double:6
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:189.235
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.41
LogP (Chemaxon):2.11

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Descriptor Annotations

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