TL;DR: 5-(3-(Bromoacetamido)allyl)uridine-3'-monophosphate (CAS 144978-95-0) is a chemical compound with molecular formula C14H19BrN3O10P and molecular weight 498.99915 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,3S,4R,5R)-5-[5-[(E)-3-[(2-bromoacetyl)amino]prop-2-enyl]-2,4-dioxopyrimidin-1-yl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate
Also Known As: Brac-ump, 5-(3-(Bromoacetamido)allyl)uridine-3'-monophosphate, 5-(3-(bromoacetamido)allyl)uridine-3/'-monophosphate, [(2R,3S,4R,5R)-5-[5-[(E)-3-[(2-bromoacetyl)amino]prop-2-enyl]-2,4-dioxopyrimidin-1-yl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate, 3'-Uridylic acid,5-[3-[(bromoacetyl)amino]-1-propenyl]- (9CI)
| Molecular Formula | C14H19BrN3O10P |
| Molecular Weight | 498.99915 g/mol |
| XLogP | -3.3 |
| Topological Polar Surface Area (TPSA) | 195.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 498.99915 Da |
| Heavy Atoms | 29 |
| Complexity | 769.0 |
| SMILES | C1=C(C(=O)NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)OP(=O)(O)O)O)C/C=C/NC(=O)CBr |
| InChIKey | BHEOWXWZDABYGJ-KNPYVMOCSA-N |
The XLogP value of -3.3 indicates that 5-(3-(Bromoacetamido)allyl)uridine-3'-monophosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 195.0 Ų indicates high polarity, suggesting 5-(3-(Bromoacetamido)allyl)uridine-3'-monophosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-(3-(Bromoacetamido)allyl)uridine-3'-monophosphate has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 5-(3-(Bromoacetamido)allyl)uridine-3'-monophosphate is 144978-95-0.
The molecular formula of 5-(3-(Bromoacetamido)allyl)uridine-3'-monophosphate is C14H19BrN3O10P.
The molecular weight of 5-(3-(Bromoacetamido)allyl)uridine-3'-monophosphate is 498.99915 g/mol.
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