Chemical ID: 5771415

Cc1ccc(cc1)S(=O)(=O)N2CC3c4ccccc4CCN3C2C(C)C
Chemical ID:
5771415
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1)S(=O)(=O)N2CC3c4ccccc4CCN3C2C(C)C
InChi [?]:
InChI=1/C21H26N2O2S/c1-15(2)21-22-13-12-17-6-4-5-7-19(17)20(22)14-23(21)26(24,25)18-10-8-16(3)9-11-18/h4-11,15,20-21H,12-14H2,1-3H3
InChi Info:
AuxInfo=1/0/N:25,26,1,17,16,18,15,3,7,4,6,20,21,12,24,2,19,5,14,13,23,22,11,9,10,8/E:(1,2)(8,9)(10,11)(24,25)/CRV:26.6/rA:26cCCCCCCCSOONCCCCCCCCCCNCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;d8;s8;s11;s12;s13;s14;d15;s16;d17;d14s18;s19;s20;s13s21;s11s22;s23;s24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H26N2O2S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:4
ZAP Information [?]
Total:11.3566
Area:540.501
Solvation:-2.15598
Coulombic:-15.8258
Bond Count [?]
All:29
Single:21
Double:8
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:370.509
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:4.1
LogP (Chemaxon):4.72

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