Biotin-PEG4-amido-methyltetrazine
Catalog Number | R08-0030 |
Category | Tetrazines |
Molecular Formula | C31H46N8O7S |
Molecular Weight | 674.8 |
Catalog Number | Size | Price | Quantity |
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R08-0030 | -- | $-- |
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Chemical Information |
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Purity | 98% |
IUPAC Name | 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[2-[2-[2-[2-[2-[[2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenyl]acetyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]pentanamide |
Canonical SMILES | CC1=NN=C(N=N1)C2=CC=C(C=C2)CC(=O)NCCOCCOCCOCCOCCNC(=O)CCCCC3C4C(CS3)NC(=O)N4 |
InChI | InChI=1S/C31H46N8O7S/c1-22-36-38-30(39-37-22)24-8-6-23(7-9-24)20-28(41)33-11-13-44-15-17-46-19-18-45-16-14-43-12-10-32-27(40)5-3-2-4-26-29-25(21-47-26)34-31(42)35-29/h6-9,25-26,29H,2-5,10-21H2,1H3,(H,32,40)(H,33,41)(H2,34,35,42)/t25-,26-,29-/m0/s1 |
InChI Key | QRSYEABVWKQKTN-ZEZDXWPOSA-N |
- Product Specification
Storage | -20 °C |
Computed Properties | |
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XLogP3 | -0.8 |
Hydrogen Bond Donor Count | 4 |
Hydrogen Bond Acceptor Count | 12 |
Rotatable Bond Count | 23 |
Exact Mass | 674.32101701 g/mol |
Monoisotopic Mass | 674.32101701 g/mol |
Topological Polar Surface Area | 213Ų |
Heavy Atom Count | 47 |
Formal Charge | 0 |
Complexity | 924 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 3 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
Applications of Fluorescent Probes & Dyes
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