2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine

C159H131N11O9S5 — CID 161125563

About 2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine

2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine (PubChem CID 161125563) has the molecular formula C159H131N11O9S5 and a molecular weight of 2500.20 g/mol. Its IUPAC name is 2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine.

Molecular Properties

• Compound Name: 2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine
• PubChem CID: 161125563
• Molecular Formula: C159H131N11O9S5
• Molecular Weight: 2500.20 g/mol
• Exact Mass: 2497.87
• IUPAC Name: 2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine
• SMILES: Cc1cc(S(=O)(=O)c2cccnc2)ccc1N1c2ccc(-c3ccccc3)cc2C(C)(C)c2cc(-c3ccccc3)ccc21.Cc1cc(S(=O)(=O)c2cccnc2)ccc1N1c2ccccc2C(C)(C)c2cc(N3c4ccccc4C(C)(C)c4ccccc43)ccc21.Cc1cc(S(=O)(=O)c2cccnc2)ccc1N1c2ccccc2C(C)(C)c2cc(N3c4ccccc4Oc4ccccc43)ccc21.Cc1cc(S(=O)(=O)c2cccnc2)ccc1N1c2ccccc2C(C)(C)c2cc(N3c4ccccc4Sc4ccccc43)ccc21
• InChI: InChI=1S/C42H37N3O2S.C39H31N3O3S.C39H31N3O2S2.C39H32N2O2S/c1-28-25-30(48(46,47)31-13-12-24-43-27-31)21-23-36(28)45-39-19-11-8-16-34(39)42(4,5)35-26-29(20-22-40(35)45)44-37-17-9-6-14-32(37)41(2,3)33-15-7-10-18-38(33)44;2*1-26-23-28(46(43,44)29-11-10-22-40-25-29)19-21-32(26)42-33-13-5-4-12-30(33)39(2,3)31-24-27(18-20-34(31)42)41-35-14-6-8-16-37(35)45-38-17-9-7-15-36(38)41;1-27-23-32(44(42,43)33-15-10-22-40-26-33)18-21-36(27)41-37-19-16-30(28-11-6-4-7-12-28)24-34(37)39(2,3)35-25-31(17-20-38(35)41)29-13-8-5-9-14-29/h6-27H,1-5H3;2*4-25H,1-3H3;4-26H,1-3H3
• InChIKey: ULMZKHIXWHSFEQ-UHFFFAOYSA-N
• XLogP: 40.28
• TPSA: 220.03 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 17
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2500.20
LogP ≤ 5	40.28
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine?

The IUPAC name of 2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine (CID 161125563) is 2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine.

What is the SMILES notation for 2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine?

The canonical SMILES for 2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine is Cc1cc(S(=O)(=O)c2cccnc2)ccc1N1c2ccc(-c3ccccc3)cc2C(C)(C)c2cc(-c3ccccc3)ccc21.Cc1cc(S(=O)(=O)c2cccnc2)ccc1N1c2ccccc2C(C)(C)c2cc(N3c4ccccc4C(C)(C)c4ccccc43)ccc21.Cc1cc(S(=O)(=O)c2cccnc2)ccc1N1c2ccccc2C(C)(C)c2cc(N3c4ccccc4Oc4ccccc43)ccc21.Cc1cc(S(=O)(=O)c2cccnc2)ccc1N1c2ccccc2C(C)(C)c2cc(N3c4ccccc4Sc4ccccc43)ccc21.

What is the InChIKey of 2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine?

The InChIKey is ULMZKHIXWHSFEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H37N3O2S.C39H31N3O3S.C39H31N3O2S2.C39H32N2O2S/c1-28-25-30(48(46,47)31-13-12-24-43-27-31)21-23-36(28)45-39-19-11-8-16-34(39)42(4,5)35-26-29(20-22-40(35)45)44-37-17-9-6-14-32(37)41(2,3)33-15-7-10-18-38(33)44;2*1-26-23-28(46(43,44)29-11-10-22-40-25-29)19-21-32(26)42-33-13-5-4-12-30(33)39(2,3)31-24-27(18-20-34(31)42)41-35-14-6-8-16-37(35)45-38-17-9-7-15-36(38)41;1-27-23-32(44(42,43)33-15-10-22-40-26-33)18-21-36(27)41-37-19-16-30(28-11-6-4-7-12-28)24-34(37)39(2,3)35-25-31(17-20-38(35)41)29-13-8-5-9-14-29/h6-27H,1-5H3;2*4-25H,1-3H3;4-26H,1-3H3.

What are the key properties of 2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine?

2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine has a molecular weight of 2500.20 g/mol, XLogP of 40.28, 17 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenothiazine;10-[9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)acridin-2-yl]phenoxazine;9,9-dimethyl-10-(2-methyl-4-pyridin-3-ylsulfonylphenyl)-2,7-diphenylacridine is sourced from PubChem (CID 161125563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).