- 6-Fluoro-1,2,3,4-tetrahydro-2-methylquinoline
- 6-Fluoro-1,2,3,4-tetrahydroisoquinoline
- 6-Fluoro-1,2,3,4-tetrahydroisoquinoline hydrochloride
- 6-Fluoro-1,2,3,4-tetrahydroquinoline
- 6-Fluoro-1,2-benzoisothiazol-3(2H)-one
- 6-Fluoro-1,3,4,5-tetrahydro-3-[4-[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]-1H-1,2,3-triazol-1-yl]-1-(2,2,2-trifluoroethyl)-2H-1-benzazepin-2-one
- 6-Fluoro-1H-indazole
- 6-Fluoro-1H-indazole-3-carboxylic acid
- 6-Fluoro-1H-indol-3-methylamine
- 6-Fluoro-1H-indole-3-carboxylic acid
- 1093980-57-41H-Imidazole, 1-(4-ethynyl-2-methoxyphenyl)-4-methyl-
- 1094042-01-9CYM 5442
- 1094067-13-6SCH1473759 (HCl salt)
- 1094069-99-4SCH1473759
- 1094070-51-5methyl 5-aminoisothiazole-3-carboxylate
- 1094070-77-5tert-Butyl (2-bromothiazol-5-yl)carbamate
- 1094-08-210H-Phenothiazine-10-ethanamine,N,N-diethyl-a-methyl-,hydrochloride (1:1)
- 109-42-210-Undecenoic acid,butyl ester
- 109425-51-6L-Histidine,N-[(9H-fluoren-9-ylmethoxy)carbonyl]-1-(triphenylmethyl)-
- 109425-55-0Fmoc-Orn(Boc)-OH
Hot Products
- 104987-11-3Tacrolimus
- 141-53-7Sodium formate
- 8001-54-5Quaternary ammonium compounds, alkylbenzyldimethyl, chlorides
- 9003-39-8Povidone
- 10161-34-9Trenbolone acetate
- 402957-28-2Telaprevir
- 68-19-9Cyanocobalamin
- 7631-86-9Silicon dioxide
- 302-79-4Tretinoin
- 77-92-9Citric acid
|
Basic Information |
|
Post buying leads |
|
Suppliers |
| Name |
6-Fluoro-1,3,4,5-tetrahydro-3-[4-[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]-1H-1,2,3-triazol-1-yl]-1-(2,2,2-trifluoroethyl)-2H-1-benzazepin-2-one |
EINECS | N/A |
| CAS No. | 1093978-89-2 | Density | 1.43 g/cm3 |
| PSA | 78.07000 | LogP | 4.73470 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C25H22F4N6O2 | Boiling Point | 729.8 °C at 760 mmHg |
| Molecular Weight | 514.47 | Flash Point | 395.2 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
6-fluoro-3-[4-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]triazol-1-yl]-1-(2,2,2-trifluoroethyl)-4,5-dihydro-3H-1-benzazepin-2-one;2H-1-benzazepin-2-one, 6-fluoro-1,3,4,5-tetrahydro-3-[4-[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]-1H-1,2,3-triazol-1-yl]-1-(2,2,2-trifluoroethyl)-;2H-1-Benzazepin-2-one 6-fluoro-1,3,4,5-tetrahydro-3-[4-[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]-1H-1,2,3-triazol-1-yl]-1-(2,2,2-trifluoroethyl)-; |
6-Fluoro-1,3,4,5-tetrahydro-3-[4-[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]-1H-1,2,3-triazol-1-yl]-1-(2,2,2-trifluoroethyl)-2H-1-benzazepin-2-one Specification
The 6-Fluoro-1,3,4,5-tetrahydro-3-[4-[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]-1H-1,2,3-triazol-1-yl]-1-(2,2,2-trifluoroethyl)-2H-1-benzazepin-2-one, with the cas registry number 1093978-89-2, has the systematic name of 6-fluoro-3-[4-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]triazol-1-yl]-1-(2,2,2-trifluoroethyl)-4,5-dihydro-3H-1-benzazepin-2-one. The molecular formula of the chemical is C25H22F4N6O2.
The characteristics of this chemical are as followings: (1)ACD/LogP: 4.43; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 3.75; (4)ACD/LogD (pH 7.4): 4.41; (5)#H bond acceptors: 8; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 5; (8)Polar Surface Area: 78.07 Å2; (9)Index of Refraction: 1.634; (10)Molar Refractivity: 127.93 cm3; (11)Molar Volume: 357.3 cm3; (12)Polarizability: 50.71×10-24cm3; (13)Surface Tension: 46.3 dyne/cm; (14)Density: 1.43 g/cm3; (15)Flash Point: 395.2 °C; (16)Enthalpy of Vaporization: 106.53 kJ/mol; (17)Boiling Point: 729.8 °C at 760 mmHg; (18)Vapour Pressure: 3.73E-21 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Cc1cn(cn1)c2ccc(cc2OC)c3cn(nn3)C4CCc5c(cccc5F)N(C4=O)CC(F)(F)F
(2)InChI: InChI=1/C25H22F4N6O2/c1-15-11-33(14-30-15)21-8-6-16(10-23(21)37-2)19-12-35(32-31-19)22-9-7-17-18(26)4-3-5-20(17)34(24(22)36)13-25(27,28)29/h3-6,8,10-12,14,22H,7,9,13H2,1-2H3
(3)InChIKey: AAHNBILIYONQLX-UHFFFAOYAO
What can I do for you?
Get Best Price
