9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane)

C65H86N10O13P2 — CID 159261073

About 9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane)

9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane) (PubChem CID 159261073) has the molecular formula C65H86N10O13P2 and a molecular weight of 1283.44 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane).

Molecular Properties

• Compound Name: 9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane)
• PubChem CID: 159261073
• Molecular Formula: C65H86N10O13P2
• Molecular Weight: 1283.44 g/mol
• Exact Mass: 1282.61
• IUPAC Name: 9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane)
• SMILES: [2H]C[C@H]1O[C@@H](n2ccc(NC(=O)OCC3c4ccccc4-c4ccccc43)nc2=O)C[C@H]1OP(OC)N(C(C)C)C(C)C.[2H]C[C@H]1O[C@@H](n2cnc3c(NC(=O)OCC4c5ccccc5-c5ccccc54)ncnc32)C[C@H]1OP(OC)N(C(C)C)C(C)C.[3H]OC.[3H]OC
• InChI: InChI=1S/C32H39N6O5P.C31H39N4O6P.2CH4O/c1-19(2)38(20(3)4)44(40-6)43-27-15-28(42-21(27)5)37-18-35-29-30(33-17-34-31(29)37)36-32(39)41-16-26-24-13-9-7-11-22(24)23-12-8-10-14-25(23)26;1-19(2)35(20(3)4)42(38-6)41-27-17-29(40-21(27)5)34-16-15-28(32-30(34)36)33-31(37)39-18-26-24-13-9-7-11-22(24)23-12-8-10-14-25(23)26;2*1-2/h7-14,17-21,26-28H,15-16H2,1-6H3,(H,33,34,36,39);7-16,19-21,26-27,29H,17-18H2,1-6H3,(H,32,33,36,37);2*2H,1H3/t21-,27-,28-,44?;21-,27-,29-,42?;;/m11../s1/i2*5D;2*2T
• InChIKey: KWMYFBJRUJIXOM-CPLWPQGXSA-N
• XLogP: 12.38
• TPSA: 257.47 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 21
• Rotatable Bonds: 22
• Heavy Atoms: 90
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1283.44
LogP ≤ 5	12.38
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane)?

The IUPAC name of 9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane) (CID 159261073) is 9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane).

What is the SMILES notation for 9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane)?

The canonical SMILES for 9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane) is [2H]C[C@H]1O[C@@H](n2ccc(NC(=O)OCC3c4ccccc4-c4ccccc43)nc2=O)C[C@H]1OP(OC)N(C(C)C)C(C)C.[2H]C[C@H]1O[C@@H](n2cnc3c(NC(=O)OCC4c5ccccc5-c5ccccc54)ncnc32)C[C@H]1OP(OC)N(C(C)C)C(C)C.[3H]OC.[3H]OC.

What is the InChIKey of 9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane)?

The InChIKey is KWMYFBJRUJIXOM-CPLWPQGXSA-N. The full InChI is InChI=1S/C32H39N6O5P.C31H39N4O6P.2CH4O/c1-19(2)38(20(3)4)44(40-6)43-27-15-28(42-21(27)5)37-18-35-29-30(33-17-34-31(29)37)36-32(39)41-16-26-24-13-9-7-11-22(24)23-12-8-10-14-25(23)26;1-19(2)35(20(3)4)42(38-6)41-27-17-29(40-21(27)5)34-16-15-28(32-30(34)36)33-31(37)39-18-26-24-13-9-7-11-22(24)23-12-8-10-14-25(23)26;2*1-2/h7-14,17-21,26-28H,15-16H2,1-6H3,(H,33,34,36,39);7-16,19-21,26-27,29H,17-18H2,1-6H3,(H,32,33,36,37);2*2H,1H3/t21-,27-,28-,44?;21-,27-,29-,42?;;/m11../s1/i2*5D;2*2T.

What are the key properties of 9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane)?

9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane) has a molecular weight of 1283.44 g/mol, XLogP of 12.38, 22 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 9H-fluoren-9-ylmethyl N-[1-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]-2-oxopyrimidin-4-yl]carbamate;9H-fluoren-9-ylmethyl N-[9-[(2R,4R,5R)-5-(deuteriomethyl)-4-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyoxolan-2-yl]purin-6-yl]carbamate;bis(tritiooxymethane) is sourced from PubChem (CID 159261073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).