5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium

C56H110ClF2N7O12P2S4U4 — CID 160701918

About 5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium

5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium (PubChem CID 160701918) has the molecular formula C56H110ClF2N7O12P2S4U4 and a molecular weight of 2295.34 g/mol. Its IUPAC name is 5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium.

Molecular Properties

• Compound Name: 5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium
• PubChem CID: 160701918
• Molecular Formula: C56H110ClF2N7O12P2S4U4
• Molecular Weight: 2295.34 g/mol
• Exact Mass: 2293.85
• IUPAC Name: 5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium
• SMILES: CC(C)(C)SSCCCCCO.CC(C)N(C(C)C)P(Cl)N(C(C)C)C(C)C.[2H]CC1OC(n2ccc(=O)[nH]c2=O)C(F)C1O.[2H]CC1OC(n2ccc(=O)[nH]c2=O)C(F)C1OP(OCCCCCSSC(C)(C)C)N(C(C)C)C(C)C.[3H]OC.[3H]OC.[U].[U].[U].[U]
• InChI: InChI=1S/C24H43FN3O5PS2.C12H28ClN2P.C9H11FN2O4.C9H20OS2.2CH4O.4U/c1-16(2)28(17(3)4)34(31-14-10-9-11-15-35-36-24(6,7)8)33-21-18(5)32-22(20(21)25)27-13-12-19(29)26-23(27)30;1-9(2)14(10(3)4)16(13)15(11(5)6)12(7)8;1-4-7(14)6(10)8(16-4)12-3-2-5(13)11-9(12)15;1-9(2,3)12-11-8-6-4-5-7-10;2*1-2;;;;/h12-13,16-18,20-22H,9-11,14-15H2,1-8H3,(H,26,29,30);9-12H,1-8H3;2-4,6-8,14H,1H3,(H,11,13,15);10H,4-8H2,1-3H3;2*2H,1H3;;;;/i5D;;1D;;2*2T
• InChIKey: RQSOSJPUVFTKMT-SYIPKIKRSA-N
• XLogP: 12.28
• TPSA: 237.28 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 21
• Rotatable Bonds: 29
• Heavy Atoms: 88
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2295.34
LogP ≤ 5	12.28
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium?

The IUPAC name of 5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium (CID 160701918) is 5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium.

What is the SMILES notation for 5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium?

The canonical SMILES for 5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium is CC(C)(C)SSCCCCCO.CC(C)N(C(C)C)P(Cl)N(C(C)C)C(C)C.[2H]CC1OC(n2ccc(=O)[nH]c2=O)C(F)C1O.[2H]CC1OC(n2ccc(=O)[nH]c2=O)C(F)C1OP(OCCCCCSSC(C)(C)C)N(C(C)C)C(C)C.[3H]OC.[3H]OC.[U].[U].[U].[U].

What is the InChIKey of 5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium?

The InChIKey is RQSOSJPUVFTKMT-SYIPKIKRSA-N. The full InChI is InChI=1S/C24H43FN3O5PS2.C12H28ClN2P.C9H11FN2O4.C9H20OS2.2CH4O.4U/c1-16(2)28(17(3)4)34(31-14-10-9-11-15-35-36-24(6,7)8)33-21-18(5)32-22(20(21)25)27-13-12-19(29)26-23(27)30;1-9(2)14(10(3)4)16(13)15(11(5)6)12(7)8;1-4-7(14)6(10)8(16-4)12-3-2-5(13)11-9(12)15;1-9(2,3)12-11-8-6-4-5-7-10;2*1-2;;;;/h12-13,16-18,20-22H,9-11,14-15H2,1-8H3,(H,26,29,30);9-12H,1-8H3;2-4,6-8,14H,1H3,(H,11,13,15);10H,4-8H2,1-3H3;2*2H,1H3;;;;/i5D;;1D;;2*2T;;;;.

What are the key properties of 5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium?

5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium has a molecular weight of 2295.34 g/mol, XLogP of 12.28, 29 rotatable bonds, 6 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(tert-butyldisulfanyl)pentan-1-ol;1-[4-[5-(tert-butyldisulfanyl)pentoxy-[di(propan-2-yl)amino]phosphanyl]oxy-5-(deuteriomethyl)-3-fluorooxolan-2-yl]pyrimidine-2,4-dione;N-[chloro-[di(propan-2-yl)amino]phosphanyl]-N-propan-2-ylpropan-2-amine;1-[5-(deuteriomethyl)-3-fluoro-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione;bis(tritiooxymethane);uranium is sourced from PubChem (CID 160701918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).