Chemical ID: 7143415

CCc1ccccc1NC2=NC(=O)C(=C3c4ccccc4NC3=O)S2
Chemical ID:
7143415
Name [?]:
3-[2-(2-ethylphenyl)amino-4-oxo-thiazol-5-ylidene]indolin-2-one
SMILES [?]:
CCc1ccccc1NC2=NC(=O)C(=C3c4ccccc4NC3=O)S2
InChi [?]:
InChI=1/C19H15N3O2S/c1-2-11-7-3-5-9-13(11)21-19-22-18(24)16(25-19)15-12-8-4-6-10-14(12)20-17(15)23/h3-10H,2H2,1H3,(H,20,23)(H,21,22,24)
InChi Info:
AuxInfo=1/1/N:1,2,5,18,6,19,4,17,7,20,3,16,8,21,15,14,23,12,10,22,9,11,24,13,25/rA:25nCCCCCCCCNCNCOCCCCCCCCNCOS/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s11;d12;s12;w14;s15;s16;d17;s18;d19;d16s20;s21;s15s22;d23;s10s14;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H15N3O2S
All Atoms:40
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:11.0191
Area:533.03
Solvation:-2.30669
Coulombic:-50.787
Bond Count [?]
All:28
Single:18
Double:10
Rotors:3
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:349.407
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:2.91
LogP (Chemaxon):3.95

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