Chemical ID: 6008945

Cc1csc(n1)NC(=O)CN(CCCOC)C(=O)CC(C)(C)C
Chemical ID:
6008945
Name [?]:
N-(3-methoxypropyl)-3,3-dimethyl-N-[(4-methylthiazol-2-yl)carbamoylmethyl]butanamide
SMILES [?]:
Cc1csc(n1)NC(=O)CN(CCCOC)C(=O)CC(C)(C)C
InChi [?]:
InChI=1/C16H27N3O3S/c1-12-11-23-15(17-12)18-13(20)10-19(7-6-8-22-5)14(21)9-16(2,3)4/h11H,6-10H2,1-5H3,(H,17,18,20)
InChi Info:
AuxInfo=1/1/N:1,21,22,23,16,13,12,14,19,10,3,2,8,17,5,20,6,7,11,9,18,15,4/E:(2,3,4)/rA:23nCCCSCNNCOCNCCCOCCOCCCCC/rB:s1;d2;s3;s4;s2d5;s5;s7;d8;s8;s10;s11;s12;s13;s14;s15;s11;d17;s17;s19;s20;s20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H27N3O3S
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.02157
Area:578.075
Solvation:-5.43029
Coulombic:-48.0391
Bond Count [?]
All:23
Single:19
Double:4
Rotors:11
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:341.47
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.82
LogP (Chemaxon):1.65

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Descriptor Annotations

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