TL;DR: Benzyoxybenzyloxybenzylacyclouridine monophosphate (CAS 141673-56-5) is a chemical compound with molecular formula C28H29N2O9P and molecular weight 568.1611 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[2,4-dioxo-5-[[3-[(4-phenylmethoxyphenyl)methoxy]phenyl]methyl]pyrimidin-1-yl]methoxy]ethyl dihydrogen phosphate
Also Known As: Bbbaump, Benzyoxybenzyloxybenzylacyclouridine monophosphate, 2-[[2,4-dioxo-5-[[3-[(4-phenylmethoxyphenyl)methoxy]phenyl]methyl]pyrimidin-1-yl]methoxy]ethyl dihydrogen phosphate, 2,4(1H,3H)-Pyrimidinedione, 5-((3-((4-(phenylmethoxy)phenyl)methoxy)phenyl)methyl)-1-((2-(phosphonooxy)ethoxy)methyl)-, 2-({5-[(3-{[4-(Benzyloxy)phenyl]methoxy}phenyl)methyl]-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl}methoxy)ethyl dihydrogen phosphate
| Molecular Formula | C28H29N2O9P |
| Molecular Weight | 568.1611 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 14 |
| Exact Mass | 568.1611 Da |
| Heavy Atoms | 40 |
| Complexity | 896.0 |
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)COC3=CC=CC(=C3)CC4=CN(C(=O)NC4=O)COCCOP(=O)(O)O |
| InChIKey | XCOONYXZJAMJOE-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyoxybenzyloxybenzylacyclouridine monophosphate. The TPSA of 144.0 Ų indicates high polarity, suggesting Benzyoxybenzyloxybenzylacyclouridine monophosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzyoxybenzyloxybenzylacyclouridine monophosphate has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Benzyoxybenzyloxybenzylacyclouridine monophosphate is 141673-56-5.
The molecular formula of Benzyoxybenzyloxybenzylacyclouridine monophosphate is C28H29N2O9P.
The molecular weight of Benzyoxybenzyloxybenzylacyclouridine monophosphate is 568.1611 g/mol.
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