CID 172510888

C38H43N2 — CID 172510888

IUPAC—
SMILESCC(C)c1cccc(C(C)C)c1N1[C](c2ccc3c(c2)c2ccccc2n3-c2ccccc2)C(C)(C)CC1(C)C
InChIInChI=1S/C38H43N2/c1-25(2)29-18-14-19-30(26(3)4)35(29)40-36(37(5,6)24-38(40,7)8)27-21-22-34-32(23-27)31-17-12-13-20-33(31)39(34)28-15-10-9-11-16-28/h9-23,25-26H,24H2,1-8H3
InChIKeyUKTAUTHNTVMSGG-UHFFFAOYSA-N
MW527.78 g/mol
LogP10.63
Rot. Bonds5

About CID 172510888

CID 172510888 (PubChem CID 172510888) has the molecular formula C38H43N2 and a molecular weight of 527.78 g/mol.

Molecular Properties

Compound NameCID 172510888
PubChem CID172510888
Molecular FormulaC38H43N2
Molecular Weight527.78 g/mol
Exact Mass527.34
IUPAC Name—
SMILESCC(C)c1cccc(C(C)C)c1N1[C](c2ccc3c(c2)c2ccccc2n3-c2ccccc2)C(C)(C)CC1(C)C
InChIInChI=1S/C38H43N2/c1-25(2)29-18-14-19-30(26(3)4)35(29)40-36(37(5,6)24-38(40,7)8)27-21-22-34-32(23-27)31-17-12-13-20-33(31)39(34)28-15-10-9-11-16-28/h9-23,25-26H,24H2,1-8H3
InChIKeyUKTAUTHNTVMSGG-UHFFFAOYSA-N
XLogP10.63
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500527.78
LogP ≤ 510.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

CID 172510862
CID 172510862
9-phenyl-3-(9-phenylcarbazol-3-yl)-6-(2-propan-2-ylphenyl)carbazole
CID 123284746
3-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-6,9-diphenylcarbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]-6-(3-phenylphenyl)carbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]-6-(4-phenylphenyl)carbazole;9-phenyl-3-(4-phenylphenyl)-6-[4-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 165019259
3,9-diphenyl-6-[3-[3-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]phenyl]carbazole;3,9-diphenyl-6-[4-[4-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 161263241
3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
CID 20685483
3-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 90085403
CID 172510768
CID 172510768
trimethyl-[2-(9-phenylcarbazol-3-yl)-5-propan-2-yl-4-pyridinyl]silane
CID 140719743
3,9-diphenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 118449494
3-[9-[9-(3-carbazol-9-ylphenyl)carbazol-3-yl]carbazol-3-yl]-9-phenylcarbazole
CID 170315703
[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]alumane
CID 147806531
3-(9-phenylcarbazol-3-yl)-9-[4-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590601

Frequently Asked Questions

What is the IUPAC name of CID 172510888?
The IUPAC name of CID 172510888 (CID 172510888) is not available.
What is the SMILES notation for CID 172510888?
The canonical SMILES for CID 172510888 is CC(C)c1cccc(C(C)C)c1N1[C](c2ccc3c(c2)c2ccccc2n3-c2ccccc2)C(C)(C)CC1(C)C.
What is the InChIKey of CID 172510888?
The InChIKey is UKTAUTHNTVMSGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H43N2/c1-25(2)29-18-14-19-30(26(3)4)35(29)40-36(37(5,6)24-38(40,7)8)27-21-22-34-32(23-27)31-17-12-13-20-33(31)39(34)28-15-10-9-11-16-28/h9-23,25-26H,24H2,1-8H3.
What are the key properties of CID 172510888?
CID 172510888 has a molecular weight of 527.78 g/mol, XLogP of 10.63, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172510888 is sourced from PubChem (CID 172510888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).