N-[(3S,4S,9R)-2,8-dioxo-1,7-diazatricyclo[7.4.0.0³,⁷]tridecan-4-yl]thiophene-2-carboxamide
AlkaPlorer ID: AK579753
Synonym: None
IUPAC Name: N-[(3S,4S,9R)-2,8-dioxo-1,7-diazatricyclo[7.4.0.03,7]tridecan-4-yl]thiophene-2-carboxamide
Structure
SMILES: O=C(N[C@H]1CCN2C(=O)[C@H]3CCCCN3C(=O)[C@H]12)C1=CC=CS1
InChI: InChI=1S/C16H19N3O3S/c20-14(12-5-3-9-23-12)17-10-6-8-19-13(10)16(22)18-7-2-1-4-11(18)15(19)21/h3,5,9-11,13H,1-2,4,6-8H2,(H,17,20)/t10-,11+,13-/m0/s1
InChIKey: YGGBWAXXVGPHTM-LOWVWBTDSA-N
Source
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Properties Information
Molecule Weight: 333.413
TPSA？: 69.72
MolLogP？: 0.8421000000000007
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 4
Activities Information
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