CID 160880676

C292H396Si19 — CID 160880676

IUPAC—
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC1(C)c2ccccc2[Si](C)(C)c2ccccc21.CC12C3=CC=CCC3C(C)(c3ccccc31)C1CCCC12.C[Si]1(C)c2ccccc2C2(CC2)c2ccccc21.C[Si]1(C)c2ccccc2C2(CCCC2)c2ccccc21.C[Si]1(C)c2ccccc2C2(CCCCC2)c2ccccc21.C[Si]1(C)c2ccccc2Cc2ccccc21.C[Si]1(C)c2ccccc2[Si](C)(C)c2ccccc21.C[Si]1(C)c2ccccc2[Si]2(CC2)c2ccccc21.C[Si]1(C)c2ccccc2[Si]2(CCCC2)c2ccccc21.C[Si]1(C)c2ccccc2[Si]2(CCCCC2)c2ccccc21.c1ccc2c(c1)C1(CCCC1)c1ccccc1[Si]21CCCC1.c1ccc2c(c1)C1(CCCCC1)c1ccccc1[Si]21CCCCC1.c1ccc2c(c1)[Si]1(CCCC1)c1ccccc1[Si]21CCCC1.c1ccc2c(c1)[Si]1(CCCCC1)c1ccccc1[Si]21CCCCC1
InChIInChI=1S/C23H28Si.C22H28Si2.C21H24Si.C21H24.C20H24Si2.C20H24Si.C19H24Si2.C19H22Si.C18H22Si2.C17H18Si.C17H20Si.C16H18Si2.C16H20Si2.C15H16Si.14C2H6/c2*1-7-15-23(16-8-1)19-11-3-5-13-21(19)24(17-9-2-10-18-24)22-14-6-4-12-20(22)23;1-3-11-19-17(9-1)21(13-5-6-14-21)18-10-2-4-12-20(18)22(19)15-7-8-16-22;1-20-14-8-3-5-10-16(14)21(2,19-13-7-12-18(19)20)17-11-6-4-9-15(17)20;1-2-10-18-17(9-1)21(13-5-6-14-21)19-11-3-4-12-20(19)22(18)15-7-8-16-22;1-21(2)18-12-6-4-10-16(18)20(14-8-3-9-15-20)17-11-5-7-13-19(17)21;1-20(2)16-10-4-6-12-18(16)21(14-8-3-9-15-21)19-13-7-5-11-17(19)20;1-20(2)17-11-5-3-9-15(17)19(13-7-8-14-19)16-10-4-6-12-18(16)20;1-19(2)15-9-3-5-11-17(15)20(13-7-8-14-20)18-12-6-4-10-16(18)19;1-18(2)15-9-5-3-7-13(15)17(11-12-17)14-8-4-6-10-16(14)18;1-17(2)13-9-5-7-11-15(13)18(3,4)16-12-8-6-10-14(16)17;1-17(2)13-7-3-5-9-15(13)18(11-12-18)16-10-6-4-8-14(16)17;1-17(2)13-9-5-7-11-15(13)18(3,4)16-12-8-6-10-14(16)17;1-16(2)14-9-5-3-7-12(14)11-13-8-4-6-10-15(13)16;14*1-2/h2*3-6,11-14H,1-2,7-10,15-18H2;1-4,9-12H,5-8,13-16H2;3-6,8-10,17-19H,7,11-13H2,1-2H3;1-4,9-12H,5-8,13-16H2;2*4-7,10-13H,3,8-9,14-15H2,1-2H3;2*3-6,9-12H,7-8,13-14H2,1-2H3;3-10H,11-12H2,1-2H3;5-12H,1-4H3;3-10H,11-12H2,1-2H3;5-12H,1-4H3;3-10H,11H2,1-2H3;14*1-2H3
InChIKeySMZJVHAWYPTLFR-UHFFFAOYSA-N
MW4440.01 g/mol
LogP58.95
Rot. Bonds

About CID 160880676

CID 160880676 (PubChem CID 160880676) has the molecular formula C292H396Si19 and a molecular weight of 4440.01 g/mol.

Molecular Properties

Compound NameCID 160880676
PubChem CID160880676
Molecular FormulaC292H396Si19
Molecular Weight4440.01 g/mol
Exact Mass4434.66
IUPAC Name—
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC1(C)c2ccccc2[Si](C)(C)c2ccccc21.CC12C3=CC=CCC3C(C)(c3ccccc31)C1CCCC12.C[Si]1(C)c2ccccc2C2(CC2)c2ccccc21.C[Si]1(C)c2ccccc2C2(CCCC2)c2ccccc21.C[Si]1(C)c2ccccc2C2(CCCCC2)c2ccccc21.C[Si]1(C)c2ccccc2Cc2ccccc21.C[Si]1(C)c2ccccc2[Si](C)(C)c2ccccc21.C[Si]1(C)c2ccccc2[Si]2(CC2)c2ccccc21.C[Si]1(C)c2ccccc2[Si]2(CCCC2)c2ccccc21.C[Si]1(C)c2ccccc2[Si]2(CCCCC2)c2ccccc21.c1ccc2c(c1)C1(CCCC1)c1ccccc1[Si]21CCCC1.c1ccc2c(c1)C1(CCCCC1)c1ccccc1[Si]21CCCCC1.c1ccc2c(c1)[Si]1(CCCC1)c1ccccc1[Si]21CCCC1.c1ccc2c(c1)[Si]1(CCCCC1)c1ccccc1[Si]21CCCCC1
InChIInChI=1S/C23H28Si.C22H28Si2.C21H24Si.C21H24.C20H24Si2.C20H24Si.C19H24Si2.C19H22Si.C18H22Si2.C17H18Si.C17H20Si.C16H18Si2.C16H20Si2.C15H16Si.14C2H6/c2*1-7-15-23(16-8-1)19-11-3-5-13-21(19)24(17-9-2-10-18-24)22-14-6-4-12-20(22)23;1-3-11-19-17(9-1)21(13-5-6-14-21)18-10-2-4-12-20(18)22(19)15-7-8-16-22;1-20-14-8-3-5-10-16(14)21(2,19-13-7-12-18(19)20)17-11-6-4-9-15(17)20;1-2-10-18-17(9-1)21(13-5-6-14-21)19-11-3-4-12-20(19)22(18)15-7-8-16-22;1-21(2)18-12-6-4-10-16(18)20(14-8-3-9-15-20)17-11-5-7-13-19(17)21;1-20(2)16-10-4-6-12-18(16)21(14-8-3-9-15-21)19-13-7-5-11-17(19)20;1-20(2)17-11-5-3-9-15(17)19(13-7-8-14-19)16-10-4-6-12-18(16)20;1-19(2)15-9-3-5-11-17(15)20(13-7-8-14-20)18-12-6-4-10-16(18)19;1-18(2)15-9-5-3-7-13(15)17(11-12-17)14-8-4-6-10-16(14)18;1-17(2)13-9-5-7-11-15(13)18(3,4)16-12-8-6-10-14(16)17;1-17(2)13-7-3-5-9-15(13)18(11-12-18)16-10-6-4-8-14(16)17;1-17(2)13-9-5-7-11-15(13)18(3,4)16-12-8-6-10-14(16)17;1-16(2)14-9-5-3-7-12(14)11-13-8-4-6-10-15(13)16;14*1-2/h2*3-6,11-14H,1-2,7-10,15-18H2;1-4,9-12H,5-8,13-16H2;3-6,8-10,17-19H,7,11-13H2,1-2H3;1-4,9-12H,5-8,13-16H2;2*4-7,10-13H,3,8-9,14-15H2,1-2H3;2*3-6,9-12H,7-8,13-14H2,1-2H3;3-10H,11-12H2,1-2H3;5-12H,1-4H3;3-10H,11-12H2,1-2H3;5-12H,1-4H3;3-10H,11H2,1-2H3;14*1-2H3
InChIKeySMZJVHAWYPTLFR-UHFFFAOYSA-N
XLogP58.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms311
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5004440.01
LogP ≤ 558.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze CID 160880676 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 160880676?
The IUPAC name of CID 160880676 (CID 160880676) is not available.
What is the SMILES notation for CID 160880676?
The canonical SMILES for CID 160880676 is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC1(C)c2ccccc2[Si](C)(C)c2ccccc21.CC12C3=CC=CCC3C(C)(c3ccccc31)C1CCCC12.C[Si]1(C)c2ccccc2C2(CC2)c2ccccc21.C[Si]1(C)c2ccccc2C2(CCCC2)c2ccccc21.C[Si]1(C)c2ccccc2C2(CCCCC2)c2ccccc21.C[Si]1(C)c2ccccc2Cc2ccccc21.C[Si]1(C)c2ccccc2[Si](C)(C)c2ccccc21.C[Si]1(C)c2ccccc2[Si]2(CC2)c2ccccc21.C[Si]1(C)c2ccccc2[Si]2(CCCC2)c2ccccc21.C[Si]1(C)c2ccccc2[Si]2(CCCCC2)c2ccccc21.c1ccc2c(c1)C1(CCCC1)c1ccccc1[Si]21CCCC1.c1ccc2c(c1)C1(CCCCC1)c1ccccc1[Si]21CCCCC1.c1ccc2c(c1)[Si]1(CCCC1)c1ccccc1[Si]21CCCC1.c1ccc2c(c1)[Si]1(CCCCC1)c1ccccc1[Si]21CCCCC1.
What is the InChIKey of CID 160880676?
The InChIKey is SMZJVHAWYPTLFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28Si.C22H28Si2.C21H24Si.C21H24.C20H24Si2.C20H24Si.C19H24Si2.C19H22Si.C18H22Si2.C17H18Si.C17H20Si.C16H18Si2.C16H20Si2.C15H16Si.14C2H6/c2*1-7-15-23(16-8-1)19-11-3-5-13-21(19)24(17-9-2-10-18-24)22-14-6-4-12-20(22)23;1-3-11-19-17(9-1)21(13-5-6-14-21)18-10-2-4-12-20(18)22(19)15-7-8-16-22;1-20-14-8-3-5-10-16(14)21(2,19-13-7-12-18(19)20)17-11-6-4-9-15(17)20;1-2-10-18-17(9-1)21(13-5-6-14-21)19-11-3-4-12-20(19)22(18)15-7-8-16-22;1-21(2)18-12-6-4-10-16(18)20(14-8-3-9-15-20)17-11-5-7-13-19(17)21;1-20(2)16-10-4-6-12-18(16)21(14-8-3-9-15-21)19-13-7-5-11-17(19)20;1-20(2)17-11-5-3-9-15(17)19(13-7-8-14-19)16-10-4-6-12-18(16)20;1-19(2)15-9-3-5-11-17(15)20(13-7-8-14-20)18-12-6-4-10-16(18)19;1-18(2)15-9-5-3-7-13(15)17(11-12-17)14-8-4-6-10-16(14)18;1-17(2)13-9-5-7-11-15(13)18(3,4)16-12-8-6-10-14(16)17;1-17(2)13-7-3-5-9-15(13)18(11-12-18)16-10-6-4-8-14(16)17;1-17(2)13-9-5-7-11-15(13)18(3,4)16-12-8-6-10-14(16)17;1-16(2)14-9-5-3-7-12(14)11-13-8-4-6-10-15(13)16;14*1-2/h2*3-6,11-14H,1-2,7-10,15-18H2;1-4,9-12H,5-8,13-16H2;3-6,8-10,17-19H,7,11-13H2,1-2H3;1-4,9-12H,5-8,13-16H2;2*4-7,10-13H,3,8-9,14-15H2,1-2H3;2*3-6,9-12H,7-8,13-14H2,1-2H3;3-10H,11-12H2,1-2H3;5-12H,1-4H3;3-10H,11-12H2,1-2H3;5-12H,1-4H3;3-10H,11H2,1-2H3;14*1-2H3.
What are the key properties of CID 160880676?
CID 160880676 has a molecular weight of 4440.01 g/mol, XLogP of 58.95, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 160880676 is sourced from PubChem (CID 160880676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).