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Chemical ID: 6549337
Chemical ID:
6549337
Name [?]:
4-(4-methylthiazol-2-yl)morpholine
SMILES [?]:
Cc1csc(n1)N2CCOCC2
InChi [?]:
InChI=1/C8H12N2OS/c1-7-6-12-8(9-7)10-2-4-11-5-3-10/h6H,2-5H2,1H3
InChi Info:
AuxInfo=1/0/N:1,8,12,9,11,3,2,5,6,7,10,4/E:(2,3)(4,5)/rA:12nCCCSCNNCCOCC/rB:s1;d2;s3;s4;s2d5;s5;s7;s8;s9;s10;s7s11;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C8H12N2OS |
All Atoms: | 12 |
Heavy Atoms: | 12 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.76056 |
Area: | 336.322 |
Solvation: | -2.64748 |
Coulombic: | -20.3358 |
Bond Count [?]
All: | 13 |
Single: | 11 |
Double: | 2 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 184.26 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 2 |
XLogP: | 0.95 |
LogP (Chemaxon): | 1.4 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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