Chemical ID: 5291468

Cc1nc2c3cc4c(nc3sc2c(=O)n1CCOCCO)CC(OC4)(C)C
Chemical ID:
5291468
Name [?]:
None
SMILES [?]:
Cc1nc2c3cc4c(nc3sc2c(=O)n1CCOCCO)CC(OC4)(C)C
InChi [?]:
InChI=1/C19H23N3O4S/c1-11-20-15-13-8-12-10-26-19(2,3)9-14(12)21-17(13)27-16(15)18(24)22(11)4-6-25-7-5-23/h8,23H,4-7,9-10H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,26,27,16,20,17,19,6,22,25,2,7,5,8,4,12,10,13,23,3,9,15,21,14,18,24,11/E:(2,3)/rA:27nCCNCCCCCNCSCCONCCOCCOCCOCCC/rB:s1;d2;s3;s4;s5;d6;s7;d8;d5s9;s10;d4s11;s12;d13;s2s13;s15;s16;s17;s18;s19;s20;s8;s22;s23;s7s24;s23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H23N3O4S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:8.64396
Area:582.751
Solvation:-5.92482
Coulombic:-58.0226
Bond Count [?]
All:30
Single:24
Double:6
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:389.47
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:0.22
LogP (Chemaxon):1.4

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