HIT ID: HIT212671615
Cas No: 220355-63-5
分子式: C32H47N5O5S
分子量: 613.82
常用名: UKI-1
氢键受体数 (HBA): 6
氢键供体数 (HBD): 3
LogP: 4.440313
IUPAC: ethyl 4-[(2S)-3-(3-carbamimidoylphenyl)-2-[2,4,6-tris(propan-2-yl)benzenesulfonamido]propanoyl]piperazine-1-carboxylate
IUPAC: ethyl 4-[(2S)-3-(3-carbamimidoylphenyl)-2-[2,4,6-tris(propan-2-yl)benzenesulfonamido]propanoyl]piperazine-1-carboxylate
SMILES: CCOC(=O)N1CCN(CC1)C(=O)[C@H](Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C
SMILES: CCOC(=O)N1CCN(CC1)C(=O)[C@H](Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C
InChI key: ISJSHQTWOHGCMM-NDEPHWFRSA-N
