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Home > Pyridines > 1494675-86-3
1494675-86-3 | 1H-Pyrrolo[3,2-b]pyridine-3-carboxamide, N-(2-hydroxyethyl)-1-[(6-methoxy-5-methyl-4-pyrimidinyl)methyl]-6-methyl-
CAS No: 1494675-86-3 Catalog No: AG001LPW MDL No:
Product Description
Catalog Number:
AG001LPW
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine-3-carboxamide, N-(2-hydroxyethyl)-1-[(6-methoxy-5-methyl-4-pyrimidinyl)methyl]-6-methyl-
CAS Number:
1494675-86-3
Molecular Formula:
C18H21N5O3
Molecular Weight:
355.3910
IUPAC Name:
N-(2-hydroxyethyl)-1-[(6-methoxy-5-methylpyrimidin-4-yl)methyl]-6-methylpyrrolo[3,2-b]pyridine-3-carboxamide
InChI:
InChI=1S/C18H21N5O3/c1-11-6-15-16(20-7-11)13(17(25)19-4-5-24)8-23(15)9-14-12(2)18(26-3)22-10-21-14/h6-8,10,24H,4-5,9H2,1-3H3,(H,19,25)
InChI Key:
VDRYGTNDKXIPSK-UHFFFAOYSA-N
SMILES:
OCCNC(=O)c1cn(c2c1ncc(c2)C)Cc1ncnc(c1C)OC
Properties
Complexity:
480
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.164g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
355.398g/mol
Monoisotopic Mass:
355.164g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Literature
| Title | Journal |
|---|---|
| Azaindoles: noncovalent DprE1 inhibitors from scaffold morphing efforts, kill Mycobacterium tuberculosis and are efficacious in vivo. | Journal of medicinal chemistry 20131212 |
| Preparations and properties of ribonucleic acid polymerase from Acinetobacter calcoaceticus. | Journal of bacteriology 19760201 |
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