Chemical ID: 3881854

COc1ccc(cc1OC)CCN(Cc2cccs2)S(=O)(=O)c3ccc(cc3)S(=O)(=O)N4CCCC4
Chemical ID:
3881854
Name [?]:
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-pyrrolidin-1-ylsulfonyl-N-(2-thienylmethyl)benzenesulfonamide
SMILES [?]:
COc1ccc(cc1OC)CCN(Cc2cccs2)S(=O)(=O)c3ccc(cc3)S(=O)(=O)N4CCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H30N2O6S3
All Atoms:36
Heavy Atoms:36
Chiral Atoms:1
ZAP Information [?]
Total:11.7946
Area:770.419
Solvation:-7.46587
Coulombic:-29.4742
Bond Count [?]
All:39
Single:27
Double:12
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:550.714
H-Bond Donors:0
H-Bond Acceptors:8
XLogP:2.91
LogP (Chemaxon):3.34

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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