143658-84-8
二环[3.1.0]己烷-2,6-二羧酸,2-氨基-, (1R,2R,5S,6R)-rel- (9CI)
Name
二环[3.1.0]己烷-2,6-二羧酸,2-氨基-, (1R,2R,5S,6R)-rel- (9CI)
pro_formula
C21 H15 N5 O S
pro_molWeight
385.449
1Identification
【Name】
二环[3.1.0]己烷-2,6-二羧酸,2-氨基-, (1R,2R,5S,6R)-rel- (9CI)
【CAS】
【MDL】
MFCD01720612
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C21 H15 N5 O S
【pro_molWeight】
385.449
【Inchi】
InChI=1S/C21H15N5OS/c1-13-23-18(20(27)26(13)21-25-22-12-28-21)11-16-15-9-5-6-10-17(15)24-19(16)14-7-3-2-4-8-14/h2-12,24H,1H3/b18-11+
【InChIKey】
InChIKey=BKVRIAHUHCBQCQ-WOJGMQOQSA-N
【SMILES】
CC1=N/C(=C/c2c3ccccc3[nH]c2c4ccccc4)/C(=O)N1c5nncs5
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:6
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
二环[3.1.0]己烷-2,6-二羧酸,2-氨基-, (1R,2R,5S,6R)-rel- (9CI).cml
quick_release
5-CHLORO-3-PHENYLANTHRANIL
719-64-2
5-CHLORO-3-PHENYL-1-BENZOFURAN-2-CARBOXYLIC ACID
26965-47-9
1,2,4-TRIAZOLO(3,4-A)PHTHALAZINE, 8-CHLORO-6-PHENYL-
87540-69-0
3-PHENYL-BENZO[C]ISOXAZOLE-5-CARBOXYLIC ACID
39695-71-1
6-CHLORO-4-PHENYL-3, 4-DIHYDROQUINAZOLINE-2-CARBOXYLIC ACID
88190-77-6
4-(6-CHLORO-4-PHENYL-QUINAZOLIN-2-YL)PIPERAZINE-1-CARBALDEHYDE
5960-46-3
SuppliersList
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