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| Name |
2-[(1-Acetyl-2-oxopropyl)thio]-N-cyclohexyl-1H-benzimidazole-1-carboxamide |
EINECS | N/A |
| CAS No. | 98183-15-4 | Density | 1.34g/cm3 |
| PSA | 106.36000 | LogP | 3.95630 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C19H23N3O3S | Boiling Point | N/A |
| Molecular Weight | 373.47 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
2-[(1-Acetyl-2-oxopropyl)thio]-N-cyclohexyl-1H-benzimidazole-1-carboxamide;5'-Dimethoxytrityl-N-isobutyryl-2'-deoxyGuanosine,3'-[(2-cyanoethyl)-(N,N-diisopropyl)]-phosphoramidite;DMT-dG-CEPhosphoramidite; |
2-[(1-Acetyl-2-oxopropyl)thio]-N-cyclohexyl-1H-benzimidazole-1-carboxamide Specification
The 2-[(1-Acetyl-2-oxopropyl)thio]-N-cyclohexyl-1H-benzimidazole-1-carboxamide with cas registry number of 98183-15-4, is also named 2-[(1-Acetyl-2-oxopropyl)thio]-N-cyclohexyl-1H-benzimidazole-1-carboxamide; DMT-dG-CEPhosphoramidite.
Physical properties of 2-oxopropyl)thio]-N-cyclohexyl-1H-benzimidazole-1-carboxamide:(1)ACD/LogP: 5.51; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.47; (4)ACD/LogD (pH 7.4): 4.83; (5)ACD/BCF (pH 5.5): 8349.52; (6)ACD/BCF (pH 7.4): 1882.66; (7)ACD/KOC (pH 5.5): 21782.18; (8)ACD/KOC (pH 7.4): 4911.47; (9)#H bond acceptors: 6; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 106.36 Å2; (13)Index of Refraction: 1.66; (14)Molar Refractivity: 102.52 cm3; (15)Molar Volume: 277.6 cm3; (16)Polarizability: 40.64×10-24cm3; (17)Surface Tension: 52.8 dyne/cm.
You can still convert the following datas into molecular structure: (1)SMILES:CC(=O)C(C(=O)C)Sc1nc2ccccc2n1C(=O)NC3CCCCC3; (2)InChI:InChI=1/C19H23N3O3S/c1-12(23)17(13(2)24)26-19-21-15-10-6-7-11-16(15)22(19)18(25)20-14-8-4-3-5-9-14/h6-7,10-11,14,17H,3-5,8-9H2,1-2H3,(H,20,25); (3)InChIKey:PYNJDHQMZUHVIC-UHFFFAOYAH; (4)Std. InChI:InChI=1S/C19H23N3O3S/c1-12(23)17(13(2)24)26-19-21-15-10-6-7-11-16(15)22(19)18(25)20-14-8-4-3-5-9-14/h6-7,10-11,14,17H,3-5,8-9H2,1-2H3,(H,20,25); (5)Std. InChIKey:PYNJDHQMZUHVIC-UHFFFAOYSA-N .
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