Chemical ID: 5227138

C1CCC2(CC1)N3C(=NC(=O)O2)OC4(CCCCC4)OC3=O
Chemical ID:
5227138
Name [?]:
None
SMILES [?]:
C1CCC2(CC1)N3C(=NC(=O)O2)OC4(CCCCC4)OC3=O
InChi [?]:
InChI=1/C15H20N2O5/c18-12-16-11-17(14(21-12)7-3-1-4-8-14)13(19)22-15(20-11)9-5-2-6-10-15/h1-10H2
InChi Info:
AuxInfo=1/0/N:1,17,2,6,16,18,3,5,15,19,8,10,21,4,14,9,7,11,22,13,12,20/E:(3,4)(5,6)(7,8)(9,10)/rA:22nCCCCCCNCNCOOOCCCCCCOCO/rB:s1;s2;s3;s4;s1s5;s4;s7;d8;s9;d10;s4s10;s8;s13;s14;s15;s16;s17;s14s18;s14;s7s20;d21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H20N2O5
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.39496
Area:444.562
Solvation:-1.71908
Coulombic:-68.6119
Bond Count [?]
All:25
Single:22
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:308.33
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:3.38
LogP (Chemaxon):4.67

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