benzamide, n-(bis(2-(2,6-dioxo-4-methyl-1,2,3,6-tetrahydro-1-pyrimidinyl)ethyl)phosphinyl)-, disodium salt
Basic information
- CAS
84295-09-0- Standard SMILES
Cc1cc(=O)n(CC[N-]P(=O)([N-]CCn2c(=O)cc(C)[nH]c2=O)NC(=O)c2ccccc2)c(=O)[nH]1.[Na+].[Na+]- InChIKey
HIDYIRNKSGAAAE-UHFFFAOYSA-L- Molecular formula
- C21H24N7Na2O6P
- Average molar mass
- 547.4 g/mol
- Monoisotopic mass
- 547.13210707
Names & identifiers
- Preferred name
- benzamide, n-(bis(2-(2,6-dioxo-4-methyl-1,2,3,6-tetrahydro-1-pyrimidinyl)ethyl)phosphinyl)-, disodium salt
- IUPAC
- disodium;[benzamido-[2-(6-methyl-2,4-dioxo-1H-pyrimidin-3-yl)ethylazanidyl]phosphoryl]-[2-(6-methyl-2,4-dioxo-1H-pyrimidin-3-yl)ethyl]azanide
- English name
- disodium [benzamido-[2-(4-methyl-2,6-dioxo-3H-pyrimidin-1-yl)ethylazan idyl]phosphoryl]-[2-(4-methyl-2,6-dioxo-3H-pyrimidin-1-yl)ethyl]azanid e
- Molecular formula
- C21H24N7Na2O6P
- Molecular weight
- 547.411861
Names & synonyms
84295-09-0Benzamide, N-(bis(2-(2,6-dioxo-4-methyl-1,2,3,6-tetrahydro-1-pyrimidinyl)ethyl)phosphinyl)-, disodium saltN-Benzoyl-N',N''-bis(beta-(6-methyluracil-3)ethyl)triamide of phosphoric acid disodium saltDTXSID20233252RefChem:322436DTXCID20155743Disodium benzamido-N,N'-bis[2-(4-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl)ethyl](oxo)-lambda~5~-phosphanebis(aminide)disodium [benzamido-[2-(4-methyl-2,6-dioxo-3H-pyrimidin-1-yl)ethylazan idyl]phosphoryl]-[2-(4-methyl-2,6-dioxo-3H-pyrimidin-1-yl)ethyl]azanid e
Database identifiers
- CAS
84295-09-0- PubChem CID
- 3069079
- DTXSID
DTXSID20233252
Properties
Computed structural properties
- Topological polar surface area
- 147 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 944
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