Chemical ID: 4264893

CC(C)(C)OC(=O)NC(CCCCNC=O)C(=O)O
Chemical ID:
4264893
Name [?]:
6-formamido-2-tert-butoxycarbonylamino-hexanoic acid
SMILES [?]:
CC(C)(C)OC(=O)NC(CCCCNC=O)C(=O)O
InChi [?]:
InChI=1/C12H22N2O5/c1-12(2,3)19-11(18)14-9(10(16)17)6-4-5-7-13-8-15/h8-9H,4-7H2,1-3H3,(H,13,15)(H,14,18)(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,3,4,11,12,10,13,15,9,17,6,2,14,8,16,18,19,7,5/E:(1,2,3)(16,17)/rA:19cCCCCOCONCCCCCNCOCOO/rB:s1;s2;s2;s2;s5;d6;s6;s8;s9;s10;s11;s12;s13;s14;d15;s9;d17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H22N2O5
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:8.37049
Area:505.041
Solvation:-4.25553
Coulombic:-79.3746
Bond Count [?]
All:18
Single:15
Double:3
Rotors:11
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:274.314
H-Bond Donors:3
H-Bond Acceptors:7
XLogP:1.0
LogP (Chemaxon):0.24

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