N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane

C26H33FN3O6P5 — CID 159717157

About N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane

N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane (PubChem CID 159717157) has the molecular formula C26H33FN3O6P5 and a molecular weight of 657.43 g/mol. Its IUPAC name is N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane.

Molecular Properties

• Compound Name: N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane
• PubChem CID: 159717157
• Molecular Formula: C26H33FN3O6P5
• Molecular Weight: 657.43 g/mol
• Exact Mass: 657.10
• IUPAC Name: N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane
• SMILES: CCc1c2c(nc3cc(F)c(C)c(CNC(=O)CO)c13)-c1cc3c(c(=O)n1C2)COC(=O)[C@]3(O)CC.PPP(P)P
• InChI: InChI=1S/C26H26FN3O6.H7P5/c1-4-13-15-9-30-20(6-17-16(24(30)33)11-36-25(34)26(17,35)5-2)23(15)29-19-7-18(27)12(3)14(22(13)19)8-28-21(32)10-31;1-4-5(2)3/h6-7,31,35H,4-5,8-11H2,1-3H3,(H,28,32);4H,1-3H2/t26-;/m0./s1
• InChIKey: MZORKWLYJVMNMK-SNYZSRNZSA-N
• XLogP: 4.13
• TPSA: 130.75 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 8
• Rotatable Bonds: 6
• Heavy Atoms: 41
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	657.43
LogP ≤ 5	4.13
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane?

The IUPAC name of N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane (CID 159717157) is N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane.

What is the SMILES notation for N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane?

The canonical SMILES for N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane is CCc1c2c(nc3cc(F)c(C)c(CNC(=O)CO)c13)-c1cc3c(c(=O)n1C2)COC(=O)[C@]3(O)CC.PPP(P)P.

What is the InChIKey of N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane?

The InChIKey is MZORKWLYJVMNMK-SNYZSRNZSA-N. The full InChI is InChI=1S/C26H26FN3O6.H7P5/c1-4-13-15-9-30-20(6-17-16(24(30)33)11-36-25(34)26(17,35)5-2)23(15)29-19-7-18(27)12(3)14(22(13)19)8-28-21(32)10-31;1-4-5(2)3/h6-7,31,35H,4-5,8-11H2,1-3H3,(H,28,32);4H,1-3H2/t26-;/m0./s1.

What are the key properties of N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane?

N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane has a molecular weight of 657.43 g/mol, XLogP of 4.13, 6 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[(19S)-10,19-diethyl-6-fluoro-19-hydroxy-7-methyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-8-yl]methyl]-2-hydroxyacetamide;diphosphanyl-bis(phosphanyl)phosphane is sourced from PubChem (CID 159717157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).