Name: DTNP
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT218847932
Cas No:3010266-66-4
常用名:DTNP
IUPAC:2-{2-[6-(cyclopropanecarbonyloxy)-2,3-dihydro-1H-xanthen-4-yl]ethenyl}-1-{3-[1-(2-{[3-({3-[({2-[(diethylamino)methyl]phenyl}methyl)carbamoyl]phenyl}carbamoyl)phenyl]formamido}ethyl)-1H-1,2,3-triazol-4-yl]propyl}-3,3-dimethyl-3H-indol-1-ium iodide
IUPAC:2-{2-[6-(cyclopropanecarbonyloxy)-2,3-dihydro-1H-xanthen-4-yl]ethenyl}-1-{3-[1-(2-{[3-({3-[({2-[(diethylamino)methyl]phenyl}methyl)carbamoyl]phenyl}carbamoyl)phenyl]formamido}ethyl)-1H-1,2,3-triazol-4-yl]propyl}-3,3-dimethyl-3H-indol-1-ium iodide
InChI key:SJOZFXONOKPEIY-UHFFFAOYSA-N

分子式:C63H67IN8O6
分子量:1159.183
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[I-].CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2cccc(c2)C(=O)NCCn2cc(CCC[N+]3=C(C=CC4=C5Oc6cc(OC(=O)C7CC7)ccc6C=C5CCC4)C(C)(C)c4ccccc34)nn2)c1
SMILES:[I-].CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2cccc(c2)C(=O)NCCn2cc(CCC[N+]3=C(C=CC4=C5Oc6cc(OC(=O)C7CC7)ccc6C=C5CCC4)C(C)(C)c4ccccc34)nn2)c1

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