Density functional theory calculations, vibration spectral analysis and molecular docking of the antimicrobial agent 6-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-{[2-(morpholin-4-yl)ethyl] sulfanyl}pyrimidin-4(3H)-one

• Almutairi Maha S.,
• Soumya S.,
• Al-Wabli Reem I.,
• Joe I. Hubert,
• Attia Mohamed I.

Affiliations

Almutairi Maha S.

Department of Pharmaceutical Chemistry, College of Pharmacy, King Saud University, P.O.Box 2457, Riyadh, 11451, Saudi Arabia

Soumya S.

Centre for Molecular and Biophysics Research, Department of Physics, Mar Ivanios College(Autonomous), Thiruvananthapuram-695 015, Kerala, India

Al-Wabli Reem I.

Department of Pharmaceutical Chemistry, College of Pharmacy, King Saud University, P.O.Box 2457, Riyadh, 11451, Saudi Arabia

Joe I. Hubert

Centre for Molecular and Biophysics Research, Department of Physics, Mar Ivanios College(Autonomous), Thiruvananthapuram-695 015, Kerala, India

Attia Mohamed I.

Department of Pharmaceutical Chemistry, College of Pharmacy, King Saud University, P.O.Box 2457, Riyadh, 11451, Saudi Arabia