O5G

{(3R)-3-[(2-methoxyphenyl)methyl]morpholin-4-yl}[3-(4-methylpyridin-2-yl)-1H-pyrazol-5-yl]methanone

Created:	2019-06-11
Last modified:	2020-03-11

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1 entries where O5G is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	53
Chiral Atom Count	1
Bond Count	56
Aromatic Bond Count	17

2D diagram of O5G

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Chemical Component Summary
Name	{(3R)-3-[(2-methoxyphenyl)methyl]morpholin-4-yl}[3-(4-methylpyridin-2-yl)-1H-pyrazol-5-yl]methanone
Systematic Name (OpenEye OEToolkits)	[(3~{R})-3-[(2-methoxyphenyl)methyl]morpholin-4-yl]-[3-(4-methylpyridin-2-yl)-1~{H}-pyrazol-5-yl]methanone
Formula	C₂₂ H₂₄ N₄ O₃
Molecular Weight	392.451
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c3(C(N2CCOCC2Cc1ccccc1OC)=O)cc(nn3)c4cc(ccn4)C
SMILES	CACTVS	3.385	COc1ccccc1C[CH]2COCCN2C(=O)c3[nH]nc(c3)c4cc(C)ccn4
SMILES	OpenEye OEToolkits	2.0.7	Cc1ccnc(c1)c2cc([nH]n2)C(=O)N3CCOCC3Cc4ccccc4OC
Canonical SMILES	CACTVS	3.385	COc1ccccc1C[C@@H]2COCCN2C(=O)c3[nH]nc(c3)c4cc(C)ccn4
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1ccnc(c1)c2cc([nH]n2)C(=O)N3CCOC[C@H]3Cc4ccccc4OC
InChI	InChI	1.03	InChI=1S/C22H24N4O3/c1-15-7-8-23-18(11-15)19-13-20(25-24-19)22(27)26-9-10-29-14-17(26)12-16-5-3-4-6-21(16)28-2/h3-8,11,13,17H,9-10,12,14H2,1-2H3,(H,24,25)/t17-/m1/s1
InChIKey	InChI	1.03	FTBXWZMCYGGBTG-QGZVFWFLSA-N

Related Resource References

Resource Name	Reference
PubChem	145994832

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