methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate

C24H24N4O7 — CID 58148020

IUPACmethyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate
SMILESCOC(=O)c1nc2c(N3CCOC3=O)cc(N3CCOCC3)cn2c(=O)c1OCc1ccccc1
InChIInChI=1S/C24H24N4O7/c1-32-23(30)19-20(35-15-16-5-3-2-4-6-16)22(29)28-14-17(26-7-10-33-11-8-26)13-18(21(28)25-19)27-9-12-34-24(27)31/h2-6,13-14H,7-12,15H2,1H3
InChIKeySSZDZEOVRSEZSJ-UHFFFAOYSA-N
MW480.48 g/mol
LogP1.85
Rot. Bonds6

About methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate

methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate (PubChem CID 58148020) has the molecular formula C24H24N4O7 and a molecular weight of 480.48 g/mol. Its IUPAC name is methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate.

Molecular Properties

Compound Namemethyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate
PubChem CID58148020
Molecular FormulaC24H24N4O7
Molecular Weight480.48 g/mol
Exact Mass480.16
IUPAC Namemethyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate
SMILESCOC(=O)c1nc2c(N3CCOC3=O)cc(N3CCOCC3)cn2c(=O)c1OCc1ccccc1
InChIInChI=1S/C24H24N4O7/c1-32-23(30)19-20(35-15-16-5-3-2-4-6-16)22(29)28-14-17(26-7-10-33-11-8-26)13-18(21(28)25-19)27-9-12-34-24(27)31/h2-6,13-14H,7-12,15H2,1H3
InChIKeySSZDZEOVRSEZSJ-UHFFFAOYSA-N
XLogP1.85
TPSA111.91 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500480.48
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

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Frequently Asked Questions

What is the IUPAC name of methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate?
The IUPAC name of methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate (CID 58148020) is methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate.
What is the SMILES notation for methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate?
The canonical SMILES for methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate is COC(=O)c1nc2c(N3CCOC3=O)cc(N3CCOCC3)cn2c(=O)c1OCc1ccccc1.
What is the InChIKey of methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate?
The InChIKey is SSZDZEOVRSEZSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O7/c1-32-23(30)19-20(35-15-16-5-3-2-4-6-16)22(29)28-14-17(26-7-10-33-11-8-26)13-18(21(28)25-19)27-9-12-34-24(27)31/h2-6,13-14H,7-12,15H2,1H3.
What are the key properties of methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate?
methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate has a molecular weight of 480.48 g/mol, XLogP of 1.85, 6 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 7-morpholin-4-yl-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylmethoxypyrido[1,2-a]pyrimidine-2-carboxylate is sourced from PubChem (CID 58148020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).