AC1MJQBR structure

AC1MJQBR

7-hydroxy-9-(4-hydroxyphenyl)-1,3-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione

Also Known As: MAS0|Oprea1_053629|Oprea1_404194|BAS 02378859|J2.668.551F|VU0488758-1|7-hydroxy-9-(4-hydroxyphenyl)-1,3-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione|7-hydroxy-9-(4-hydroxyphenyl)-1,3-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione|AG-690/40721608|SR-01000312321-1|SR-01000312321-3|F0823-0069|7-hydroxy-9-(4-hydroxyphenyl)-1,3-dimethyl-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione|2,4(1H,3H)-Dioxo-1,3-dimethyl-6,7-dihydro-6-hydroxy-8-(4-hydroxyphenyl)-1,3,4b,8,9-pentaaza-5H,8H-fluorene|6-Hydroxy-8-(4-hydroxy-phenyl)-1,3-dimethyl-5,6,7,8-tetrahydro-1H-1,3,4b,8,9-pentaaza-fluorene-2,4-dione

CAS: 335403-33-3
Molecular Formula C16H17N5O4
Molecular Weight 343.12805 g/mol
LogP -0.3481
Topological Polar Surface Area 105.52 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 1
Exact Mass 343.12805
Monoisotopic Mass 343.12805
Heavy Atoms 25
Complexity 1092.8862

Chemical Identifiers

CAS Number 335403-33-3
SMILES CN1C2=C(C(=O)N(C1=O)C)N3CC(CN(C3=N2)C4=CC=C(C=C4)O)O

Product Overview

AC1MJQBR (CAS 335403-33-3), with molecular formula C16H17N5O4 and molecular weight 343.12805 g/mol. IUPAC: 7-hydroxy-9-(4-hydroxyphenyl)-1,3-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione.

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