Chemical ID: 5897624

CC1CN(CCN1C(=O)C2CCCC2)c3cc(nc(n3)SCC(=O)N4CCC5(CC4)OCCO5)Cl
Chemical ID:
5897624
Name [?]:
2-[4-chloro-6-(4-cyclopentylcarbonyl-3-methyl-piperazin-1-yl)-pyrimidin-2-yl]sulfanyl-1-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)ethanone
SMILES [?]:
CC1CN(CCN1C(=O)C2CCCC2)c3cc(nc(n3)SCC(=O)N4CCC5(CC4)OCCO5)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H34ClN5O4S
All Atoms:35
Heavy Atoms:35
Chiral Atoms:2
ZAP Information [?]
Total:12.8426
Area:753.015
Solvation:-5.98281
Coulombic:-66.5812
Bond Count [?]
All:39
Single:34
Double:5
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:524.077
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:2.58
LogP (Chemaxon):3.66

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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