Chemical ID: 4967444

Cc1ccc(cc1)c2nc(c(o2)NC)S(=O)(=O)c3ccc(cc3)C
Chemical ID:
4967444
Name [?]:
N-methyl-2-(p-tolyl)-4-(p-tolylsulfonyl)oxazol-5-amine
SMILES [?]:
Cc1ccc(cc1)c2nc(c(o2)NC)S(=O)(=O)c3ccc(cc3)C
InChi [?]:
InChI=1/C18H18N2O3S/c1-12-4-8-14(9-5-12)16-20-18(17(19-3)23-16)24(21,22)15-10-6-13(2)7-11-15/h4-11,19H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,24,14,3,7,20,22,4,6,19,23,2,21,5,18,8,11,10,13,9,16,17,12,15/E:(4,5)(6,7)(8,9)(10,11)(21,22)/CRV:24.6/rA:24nCCCCCCCCNCCONCSOOCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s9;d10;s8s11;s11;s13;s10;d15;d15;s15;s18;d19;s20;d21;d18s22;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H18N2O3S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:11.7193
Area:547.205
Solvation:-1.96082
Coulombic:-35.6012
Bond Count [?]
All:26
Single:16
Double:10
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:342.413
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.76
LogP (Chemaxon):4.85

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