Chemical ID: 7671703

CCCc1nc2c(c(n1)SCC(=O)N3CCC(CC3)C)c(=O)n(c(=O)n2C)C
Chemical ID:
7671703
Name [?]:
None
SMILES [?]:
CCCc1nc2c(c(n1)SCC(=O)N3CCC(CC3)C)c(=O)n(c(=O)n2C)C
InChi [?]:
InChI=1/C19H27N5O3S/c1-5-6-13-20-16-15(18(26)23(4)19(27)22(16)3)17(21-13)28-11-14(25)24-9-7-12(2)8-10-24/h12H,5-11H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,20,27,28,2,3,16,18,15,19,11,17,4,12,7,6,8,21,24,5,9,26,23,14,13,22,25,10/E:(7,8)(9,10)/rA:28nCCCCNCCCNSCCONCCCCCCCONCONCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s8;s10;s11;d12;s12;s14;s15;s16;s17;s14s18;s17;s7;d21;s21;s23;d24;s6s24;s26;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H27N5O3S
All Atoms:55
Heavy Atoms:28
Chiral Atoms:None
ZAP Information [?]
Total:11.8504
Area:619.175
Solvation:-3.62893
Coulombic:-61.1531
Bond Count [?]
All:30
Single:24
Double:6
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:1.59
LogP (Chemaxon):None

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Descriptor Annotations

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