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CAS No.: | 887352-43-4 |
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Name: | 6-AMINO-5-[(CYCLOPENTANECARBONYL)AMINO]-1,3-DIMETHYL URACIL |
Molecular Structure: | |
Formula: | C12H18N4O3 |
Molecular Weight: | 266.30 |
Synonyms: | 6-Amino-5-[(cyclopentanecarbonyl)amino]-1,3-dimethyl Uracil; |
Density: | 1.34 g/cm3 |
Melting Point: | 264-266 °C |
PSA: | 102.61000 |
LogP: | 1.02560 |
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This chemical is called 6-Amino-5-[(cyclopentanecarbonyl)amino]-1,3-dimethyl uracil, and its systematic name is N-(6-amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)cyclopentanecarboxamide. With the molecular formula of C12H18N4O3, its molecular weight is 266.30. The CAS registry number of this chemical is 887352-43-4. Additionally, its product categories are Nucleotides and Nucleosides; 5-FOA; Bases & Related Reagents; Nucleotides.
Other characteristics of 6-Amino-5-[(cyclopentanecarbonyl)amino]-1,3-dimethyl uracil can be summarised as followings: (1)ACD/LogP: -0.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.03; (4)ACD/LogD (pH 7.4): -0.03; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 22.88; (8)ACD/KOC (pH 7.4): 22.91; (9)#H bond acceptors: 7; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 64.17 Å2; (13)Index of Refraction: 1.604; (14)Molar Refractivity: 68.33 cm3; (15)Molar Volume: 198.5 cm3; (16)Polarizability: 27.09×10-24cm3; (17)Surface Tension: 61.4 dyne/cm; (18)Density: 1.34 g/cm3.
You can still convert the following datas into molecular structure:
1.SMILES: O=C1N(/C(=C(\C(=O)N1C)NC(=O)C2CCCC2)N)C
2.InChI: InChI=1/C12H18N4O3/c1-15-9(13)8(11(18)16(2)12(15)19)14-10(17)7-5-3-4-6-7/h7H,3-6,13H2,1-2H3,(H,14,17)
3.InChIKey: DPULTBHBMZPYTC-UHFFFAOYAF
4.Std. InChI: InChI=1S/C12H18N4O3/c1-15-9(13)8(11(18)16(2)12(15)19)14-10(17)7-5-3-4-6-7/h7H,3-6,13H2,1-2H3,(H,14,17)
5.Std. InChIKey: DPULTBHBMZPYTC-UHFFFAOYSA-N