Chemical ID: 6215252

CC1CN(CC(O1)C)S(=O)(=O)c2c(cc(cc2C(C)C)C(C)C)C(C)C
Chemical ID:
6215252
Name [?]:
2,6-dimethyl-4-(2,4,6-triisopropylphenyl)sulfonyl-morpholine
SMILES [?]:
CC1CN(CC(O1)C)S(=O)(=O)c2c(cc(cc2C(C)C)C(C)C)C(C)C
InChi [?]:
InChI=1/C21H35NO3S/c1-13(2)18-9-19(14(3)4)21(20(10-18)15(5)6)26(23,24)22-11-16(7)25-17(8)12-22/h9-10,13-17H,11-12H2,1-8H3
InChi Info:
AuxInfo=1/0/N:22,23,19,20,25,26,1,8,16,14,3,5,21,18,24,2,6,15,17,13,12,4,10,11,7,9/E:(1,2)(3,4,5,6)(7,8)(9,10)(11,12)(14,15)(16,17)(19,20)(23,24)/CRV:26.6/rA:26cCCCNCCOCSOOCCCCCCCCCCCCCCC/rB:s1;s2;s3;s4;s5;s2s6;s6;s4;d9;d9;s9;s12;d13;s14;d15;d12s16;s17;s18;s18;s15;s21;s21;s13;s24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H35NO3S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:2
ZAP Information [?]
Total:11.7625
Area:571.339
Solvation:-2.52094
Coulombic:-18.9628
Bond Count [?]
All:27
Single:22
Double:5
Rotors:5
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:381.574
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:5.42
LogP (Chemaxon):5.24

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Descriptor Annotations

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