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| CAS No.: | 382180-17-8 |
|---|---|
| Name: | Pyroxamide |
| Molecular Structure: | |
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| Formula: | C13H19N3O3 |
| Molecular Weight: | 265.312 |
| Synonyms: | Octanediamide,N-hydroxy-N'-3-pyridinyl- (9CI);Pyroxamide; |
| Density: | 1.215 g/cm3 |
| Hazard Symbols: | Xn |
| Risk Codes: | 22 |
| PSA: | 91.32000 |
| LogP: | 2.33000 |
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Specification
The CAS register number of Pyroxamide is 382180-17-8. It also can be called as Suberoyl-3-aminopyridineamide hydroxamic acid and the IUPAC name about this chemical is N'-hydroxy-N-pyridin-3-yloctanediamide. Classification code about this chemical is Histone deacetylase inhibitor.
Physical properties about Pyroxamide are: (1)ACD/LogP: 0.04; (2)ACD/LogD (pH 5.5): -0.04; (3)ACD/LogD (pH 7.4): 0.03; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 21.08; (7)ACD/KOC (pH 7.4): 24.73; (8)#H bond acceptors: 6; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 9; (11)Polar Surface Area: 62.74Å2; (12)Index of Refraction: 1.569; (13)Molar Refractivity: 71.57 cm3; (14)Molar Volume: 218.2 cm3; (15)Polarizability: 28.37x10-24cm3; (16)Surface Tension: 54.7 dyne/cm.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1cccnc1)CCCCCCC(=O)NO
(2)InChI: InChI=1/C13H19N3O3/c17-12(15-11-6-5-9-14-10-11)7-3-1-2-4-8-13(18)16-19/h5-6,9-10,19H,1-4,7-8H2,(H,15,17)(H,16,18)
(3)InChIKey: PTJGLFIIZFVFJV-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C13H19N3O3/c17-12(15-11-6-5-9-14-10-11)7-3-1-2-4-8-13(18)16-19/h5-6,9-10,19H,1-4,7-8H2,(H,15,17)(H,16,18)
(5)Std. InChIKey: PTJGLFIIZFVFJV-UHFFFAOYSA-N