2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole

C100H58N8O4S10 — CID 177390539

IUPAC2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole
SMILESc1ccc(-c2nnc(-c3ccc(/C(c4ccc(-c5cccs5)s4)=c4\cc/c(=c5/cc/c(=C(\c6ccc(-c7nnc(-c8ccccc8)o7)cc6)c6ccc(-c7ccc(/C(c8ccc(-c9nnc(-c%10ccccc%10)o9)cc8)=c8\cc/c(=c9/cc/c(=C(\c%10ccc(-c%11nnc(-c%12ccccc%12)o%11)cc%10)c%10ccc(-c%11cccs%11)s%10)s9)s8)s7)s6)s5)s4)cc3)o2)cc1
InChIInChI=1S/C100H58N8O4S10/c1-5-15-63(16-6-1)93-101-105-97(109-93)67-33-25-59(26-34-67)89(81-49-41-73(115-81)71-23-13-57-113-71)83-51-43-75(117-83)77-45-53-85(119-77)91(61-29-37-69(38-30-61)99-107-103-95(111-99)65-19-9-3-10-20-65)87-55-47-79(121-87)80-48-56-88(122-80)92(62-31-39-70(40-32-62)100-108-104-96(112-100)66-21-11-4-12-22-66)86-54-46-78(120-86)76-44-52-84(118-76)90(82-50-42-74(116-82)72-24-14-58-114-72)60-27-35-68(36-28-60)98-106-102-94(110-98)64-17-7-2-8-18-64/h1-58H/b77-75+,78-76+,89-83-,90-84-,91-85-,92-86+
InChIKeyASAKJNOYWOLIAN-ZFIYEIHPSA-N
MW1756.29 g/mol
LogP25.73
Rot. Bonds19

About 2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole

2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole (PubChem CID 177390539) has the molecular formula C100H58N8O4S10 and a molecular weight of 1756.29 g/mol. Its IUPAC name is 2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole
PubChem CID177390539
Molecular FormulaC100H58N8O4S10
Molecular Weight1756.29 g/mol
Exact Mass1754.18
IUPAC Name2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole
SMILESc1ccc(-c2nnc(-c3ccc(/C(c4ccc(-c5cccs5)s4)=c4\cc/c(=c5/cc/c(=C(\c6ccc(-c7nnc(-c8ccccc8)o7)cc6)c6ccc(-c7ccc(/C(c8ccc(-c9nnc(-c%10ccccc%10)o9)cc8)=c8\cc/c(=c9/cc/c(=C(\c%10ccc(-c%11nnc(-c%12ccccc%12)o%11)cc%10)c%10ccc(-c%11cccs%11)s%10)s9)s8)s7)s6)s5)s4)cc3)o2)cc1
InChIInChI=1S/C100H58N8O4S10/c1-5-15-63(16-6-1)93-101-105-97(109-93)67-33-25-59(26-34-67)89(81-49-41-73(115-81)71-23-13-57-113-71)83-51-43-75(117-83)77-45-53-85(119-77)91(61-29-37-69(38-30-61)99-107-103-95(111-99)65-19-9-3-10-20-65)87-55-47-79(121-87)80-48-56-88(122-80)92(62-31-39-70(40-32-62)100-108-104-96(112-100)66-21-11-4-12-22-66)86-54-46-78(120-86)76-44-52-84(118-76)90(82-50-42-74(116-82)72-24-14-58-114-72)60-27-35-68(36-28-60)98-106-102-94(110-98)64-17-7-2-8-18-64/h1-58H/b77-75+,78-76+,89-83-,90-84-,91-85-,92-86+
InChIKeyASAKJNOYWOLIAN-ZFIYEIHPSA-N
XLogP25.73
TPSA155.68 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds19
Heavy Atoms122
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001756.29
LogP ≤ 525.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze 2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole with MolForge

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole?
The IUPAC name of 2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole (CID 177390539) is 2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole.
What is the SMILES notation for 2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole?
The canonical SMILES for 2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole is c1ccc(-c2nnc(-c3ccc(/C(c4ccc(-c5cccs5)s4)=c4\cc/c(=c5/cc/c(=C(\c6ccc(-c7nnc(-c8ccccc8)o7)cc6)c6ccc(-c7ccc(/C(c8ccc(-c9nnc(-c%10ccccc%10)o9)cc8)=c8\cc/c(=c9/cc/c(=C(\c%10ccc(-c%11nnc(-c%12ccccc%12)o%11)cc%10)c%10ccc(-c%11cccs%11)s%10)s9)s8)s7)s6)s5)s4)cc3)o2)cc1.
What is the InChIKey of 2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole?
The InChIKey is ASAKJNOYWOLIAN-ZFIYEIHPSA-N. The full InChI is InChI=1S/C100H58N8O4S10/c1-5-15-63(16-6-1)93-101-105-97(109-93)67-33-25-59(26-34-67)89(81-49-41-73(115-81)71-23-13-57-113-71)83-51-43-75(117-83)77-45-53-85(119-77)91(61-29-37-69(38-30-61)99-107-103-95(111-99)65-19-9-3-10-20-65)87-55-47-79(121-87)80-48-56-88(122-80)92(62-31-39-70(40-32-62)100-108-104-96(112-100)66-21-11-4-12-22-66)86-54-46-78(120-86)76-44-52-84(118-76)90(82-50-42-74(116-82)72-24-14-58-114-72)60-27-35-68(36-28-60)98-106-102-94(110-98)64-17-7-2-8-18-64/h1-58H/b77-75+,78-76+,89-83-,90-84-,91-85-,92-86+.
What are the key properties of 2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole?
2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole has a molecular weight of 1756.29 g/mol, XLogP of 25.73, 19 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-[4-[(Z)-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[5-[5-[(E)-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-[(5E)-5-[(5Z)-5-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-(5-thiophen-2-ylthiophen-2-yl)methylidene]thiophen-2-ylidene]thiophen-2-ylidene]methyl]thiophen-2-yl]thiophen-2-yl]methylidene]thiophen-2-ylidene]thiophen-2-ylidene]-(5-thiophen-2-ylthiophen-2-yl)methyl]phenyl]-1,3,4-oxadiazole is sourced from PubChem (CID 177390539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).