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Basic Information |
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Product Name: | PD 123319 DITRIFLUOROACETATE |
CAS: | 130663-39-7 ;136676-91-0 |
English Synonyms: | 1H-IMIDAZO[4,5-C]PYRIDINE-6-CARBOXYLIC ACID, 1-[[4-(DIMETHYLAMINO)-3-METHYLPHENYL]METHYL]-5-(2,2-DIPHENYLACETYL)-4,5,6,7-TETRAHYDRO-, ACETIC ACID, 2,2,2-TRIFLUORO-(1:2), (6S)- ; (S)-1-(4-DIMETHYLAMINO-3-METHYL-BENZYL)-5-DIPHENYLACETYL-4,5,6,7-TETRAHYDRO-1H-IMIDAZO[4,5-C]PYRIDINE-6-CARBOXYLIC ACID DITRIFLUOROACETATE ; PD 123319 (DITRIFLUOROACETATE) ; PD 123319 DITRIFLUOROACETATE |
MDL Number.: | MFCD08276969 |
H bond acceptor: | 7 |
H bond donor: | 1 |
Smile: | Cc1cc(ccc1N(C)C)Cn2cnc3c2C[C@H](N(C3)C(=O)C(c4ccccc4)c5ccccc5)C(=O)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O |
InChi: | InChI=1S/C31H32N4O3.2C2HF3O2/c1-21-16-22(14-15-26(21)33(2)3)18-34-20-32-25-19-35(28(31(37)38)17-27(25)34)30(36)29(23-10-6-4-7-11-23)24-12-8-5-9-13-24;2*3-2(4,5)1(6)7/h4-16,20,28-29H,17-19H2,1-3H3,(H,37,38);2*(H,6,7)/t28-;;/m0../s1 |
InChiKey: | InChIKey=GPKQIEZLHVGJQH-ZXVJYWQYSA-N |
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