Product Name

  • Name

    Homo Sildenafil

  • EINECS
  • CAS No. 642928-07-2
  • Article Data4
  • CAS DataBase
  • Density 1.37 g/cm3
  • Solubility
  • Melting Point 200-202°C
  • Formula C23H32N6O4S
  • Boiling Point
  • Molecular Weight 488.611
  • Flash Point
  • Transport Information
  • Appearance White Solid
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 642928-07-2 (Homo Sildenafil)
  • Hazard Symbols
  • Synonyms 5-[2-Ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-1,6-dihydro-1-methyl-3-propyl-7H-pyrazolo[4,3-d]pyrimidin-7-one;Homo Sildenafil
  • PSA 121.80000
  • LogP 2.95760

Homo Sildenafil Specification

The Homo Sildenafil, with CAS registry number 642928-07-2, belongs to the following product categories: (1)Heterocyclic Compounds; (2)Heterocycles; (3)Intermediates & Fine Chemicals; (4)Pharmaceuticals; (5)Sulfur & Selenium Compounds. It has the systematic name of 5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-phenyl]-1-methyl-3-propyl-6H-pyrazolo[4,3-d]pyrimidin-7-one. This chemical is a kind of white solid. And the chemical formula of this chemical is C23H32N6O4S.

Physical properties of Homo Sildenafil: (1)ACD/LogP: 2.80; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 2.09; (4)ACD/LogD (pH 7.4): 2.78; (5)#H bond acceptors: 10; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 8; (8)Polar Surface Area: 117.51 Å2; (9)Index of Refraction: 1.656; (10)Molar Refractivity: 130.63 cm3; (11)Molar Volume: 355.4 cm3; (12)Polarizability: 51.78×10-24cm3; (13)Surface Tension: 53.3 dyne/cm; (14)Density: 1.37 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: CCCc1c2c(c(=O)[nH]c(n2)c3cc(ccc3OCC)S(=O)(=O)N4CCN(CC4)CC)n(n1)C
(2)InChI: InChI=1/C23H32N6O4S/c1-5-8-18-20-21(27(4)26-18)23(30)25-22(24-20)17-15-16(9-10-19(17)33-7-3)34(31,32)29-13-11-28(6-2)12-14-29/h9-10,15H,5-8,11-14H2,1-4H3,(H,24,25,30)
(3)InChIKey: MJEXYQIZUOHDGY-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C23H32N6O4S/c1-5-8-18-20-21(27(4)26-18)23(30)25-22(24-20)17-15-16(9-10-19(17)33-7-3)34(31,32)29-13-11-28(6-2)12-14-29/h9-10,15H,5-8,11-14H2,1-4H3,(H,24,25,30)
(5)Std. InChIKey: MJEXYQIZUOHDGY-UHFFFAOYSA-N

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