10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine

C37H25N3O2 — CID 122608600

IUPAC10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine
SMILESCn1c2ccc(N3c4ccccc4Oc4ccccc43)cc2c2cc(N3c4ccccc4Oc4ccccc43)ccc21
InChIInChI=1S/C37H25N3O2/c1-38-28-20-18-24(39-30-10-2-6-14-34(30)41-35-15-7-3-11-31(35)39)22-26(28)27-23-25(19-21-29(27)38)40-32-12-4-8-16-36(32)42-37-17-9-5-13-33(37)40/h2-23H,1H3
InChIKeyXNTGNBMNXSHJEQ-UHFFFAOYSA-N
MW543.63 g/mol
LogP10.48
Rot. Bonds2

About 10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine

10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine (PubChem CID 122608600) has the molecular formula C37H25N3O2 and a molecular weight of 543.63 g/mol. Its IUPAC name is 10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine.

Molecular Properties

Compound Name10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine
PubChem CID122608600
Molecular FormulaC37H25N3O2
Molecular Weight543.63 g/mol
Exact Mass543.19
IUPAC Name10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine
SMILESCn1c2ccc(N3c4ccccc4Oc4ccccc43)cc2c2cc(N3c4ccccc4Oc4ccccc43)ccc21
InChIInChI=1S/C37H25N3O2/c1-38-28-20-18-24(39-30-10-2-6-14-34(30)41-35-15-7-3-11-31(35)39)22-26(28)27-23-25(19-21-29(27)38)40-32-12-4-8-16-36(32)42-37-17-9-5-13-33(37)40/h2-23H,1H3
InChIKeyXNTGNBMNXSHJEQ-UHFFFAOYSA-N
XLogP10.48
TPSA29.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500543.63
LogP ≤ 510.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine with MolForge

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

Launch Full Analysis

Related Compounds

3,7-dimethyl-10-(9-methylcarbazol-3-yl)phenoxazine
CID 158231625
10-(7-phenoxazin-10-yl-9,10-diphenylanthracen-2-yl)phenoxazine
CID 59220139
10-(4-phenoxazin-10-ylphenyl)-14,21-dioxa-10-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 118442390
ethane;10-phenylphenoxazine
CID 123756019
10-(3-methyl-5-phenoxazin-10-ylphenyl)phenoxazine
CID 145413452
10-[4-bromo-3-(2-bromo-5-phenoxazin-10-ylphenyl)phenyl]phenoxazine
CID 177414701
10-[9,10-bis(2,4-dimethylphenyl)-6-phenoxazin-10-ylanthracen-2-yl]phenoxazine
CID 59219982
10-[6-phenoxazin-10-yl-9,10-bis(3-phenylnaphthalen-2-yl)anthracen-2-yl]phenoxazine
CID 59219992
2,6-di(phenoxazin-10-yl)anthracene-9,10-dione
CID 144761593
16-[4-(3-phenoxazin-10-ylcarbazol-9-yl)phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene
CID 164795537
10-[3,4-bis(4-methylphenyl)phenyl]phenoxazine
CID 58251267
10-(4-fluorophenyl)phenoxazine
CID 141389969

Frequently Asked Questions

What is the IUPAC name of 10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine?
The IUPAC name of 10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine (CID 122608600) is 10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine.
What is the SMILES notation for 10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine?
The canonical SMILES for 10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine is Cn1c2ccc(N3c4ccccc4Oc4ccccc43)cc2c2cc(N3c4ccccc4Oc4ccccc43)ccc21.
What is the InChIKey of 10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine?
The InChIKey is XNTGNBMNXSHJEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H25N3O2/c1-38-28-20-18-24(39-30-10-2-6-14-34(30)41-35-15-7-3-11-31(35)39)22-26(28)27-23-25(19-21-29(27)38)40-32-12-4-8-16-36(32)42-37-17-9-5-13-33(37)40/h2-23H,1H3.
What are the key properties of 10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine?
10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine has a molecular weight of 543.63 g/mol, XLogP of 10.48, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine is sourced from PubChem (CID 122608600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).