Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-
TL;DR: Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- (CAS 91067-54-8) is a chemical compound with molecular formula C16H18N4O8S and molecular weight 426.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl]-4-nitrobenzenesulfonamide
Also Known As: 5'-deoxy-5'-p-nitrobenzenesulphonylaminothymidine, Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-, 2,4(1H,3H)-Pyrimidinedione, 1-[2,5-dideoxy-5-[[(4-nitrophenyl)sulfonyl]amino]-b-D-erythro-pentofuranosyl]-5-methyl-, N-[(2R,3S,5R)-3-Hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-tetrahydro-furan-2-ylmethyl]-4-nitro-benzenesulfonamide, N-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl]-4-nitro-benzenesulfonamide
| Molecular Formula | C16H18N4O8S |
|---|---|
| Molecular Weight | 426.08 g/mol |
| LogP | -0.61988 |
| Topological Polar Surface Area | 173.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.08453 |
| Heavy Atoms | 29 |
| Complexity | 1138.7451 |
Chemical Identifiers
| CAS Number | 91067-54-8 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])O |
Product Overview
Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- (CAS 91067-54-8), with molecular formula C16H18N4O8S and molecular weight 426.08 g/mol. IUPAC: N-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl]-4-nitrobenzenesulfonamide.
Chemical Property Profile of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-
Property Insights of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-
The XLogP value of -0.61988 indicates that Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 173.63 Ų indicates high polarity, suggesting Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-?
The CAS number of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- is 91067-54-8.
What is the molecular formula of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-?
The molecular formula of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- is C16H18N4O8S.
What is the molecular weight of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-?
The molecular weight of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- is 426.08 g/mol.
Where can I buy Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-?
You can request a quote for Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-?
Yes, KEHONG BIO provides custom synthesis services for Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.