812675-69-7
3H-PYRIMIDO[5,4-B]INDOLE-9-CARBONITRILE, 4,5-DIHYDRO-5-METHYL-4-OXO-
Name
3H-PYRIMIDO[5,4-B]INDOLE-9-CARBONITRILE, 4,5-DIHYDRO-5-METHYL-4-OXO-
Formula
C12 H8 N4 O
MolWeight
224.222
1Identification
【Name】
3H-PYRIMIDO[5,4-B]INDOLE-9-CARBONITRILE, 4,5-DIHYDRO-5-METHYL-4-OXO-
【CAS】
【MDL】
MFCD17018609
【English Synonyms】
【Formula】
C12 H8 N4 O
【MolWeight】
224.222
【Inchi】
InChI=1S/C12H8N4O/c1-16-8-4-2-3-7(5-13)9(8)10-11(16)12(17)15-6-14-10/h2-4,6H,1H3,(H,14,15,17)
【InChIKey】
InChIKey=LUEIUXQXJGYDSH-UHFFFAOYSA-N
【SMILES】
Cn1c2cccc(c2c3c1c(=O)[nH]cn3)C#N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3H-PYRIMIDO[5,4-B]INDOLE-9-CARBONITRILE, 4,5-DIHYDRO-5-METHYL-4-OXO-.cml
Quick Release
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Catalog No:18-3164 1G
Catalog No:18-3164 5G
Country/Region:United States
Business Type:Others
http://www.small-molecules.com
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