4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-1H-PYMOL[2,3-D]PYRIMODIN-5-YL)ETHYL]BENZOIC ACID

CAS No.
137281-39-1
CCD No.
CCD00817329
Formula
C15 H14 N4 O3
MolWeight
298.301

Basic Information

Product Name: 4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-1H-PYMOL[2,3-D]PYRIMODIN-5-YL)ETHYL]BENZOIC ACID
CAS: 137281-39-1
English Synonyms: 4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL]-BENZOIC ACID ; 4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-1H-PYMOL[2,3-D]PYRIMODIN-5-YL)ETHYL]BENZOIC ACID ; 4-[2-(2-AMINO-4-OXO-4,7-DIHYDRO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)-ETHYL]-BENZOIC ACID ; 4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-1H-PYMOL[2,3-D]PYRIMODIN-5-YL)ETHYL] BENZOIC ACID ; 4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-1H-PYMOL[2,3-D]PYRIMIDIN-5-YL)ETHYL]BENZOIC ACID
MDL Number.: MFCD09833742
H bond acceptor: 7
H bond donor: 4
Smile: c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)O
InChi: InChI=1S/C15H14N4O3/c16-15-18-12-11(13(20)19-15)10(7-17-12)6-3-8-1-4-9(5-2-8)14(21)22/h1-2,4-5,7H,3,6H2,(H,21,22)(H4,16,17,18,19,20)
InChiKey: InChIKey=AIZPFZIKHIJCQX-UHFFFAOYSA-N

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