[4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone

C140H165N21O17S5 — CID 159230028

About [4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone

[4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone (PubChem CID 159230028) has the molecular formula C140H165N21O17S5 and a molecular weight of 2574.32 g/mol. Its IUPAC name is [4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone.

Molecular Properties

• Compound Name: [4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone
• PubChem CID: 159230028
• Molecular Formula: C140H165N21O17S5
• Molecular Weight: 2574.32 g/mol
• Exact Mass: 2572.13
• IUPAC Name: [4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone
• SMILES: COc1cc2c(cc1-c1cccnc1)-n1c(-c3ccsc3)nc(C(=O)N(C)C(C)(C)C)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(-c3cccs3)nc(C(=O)N(C)C(C)(C)C)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(-c3cccs3)nc(C(=O)N3CCCN(C(=O)C4CCC4)CC3)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(-c3ccsc3)nc(C(=O)N3CCCC(C(=O)N4CCC4)CC3)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(-c3cncs3)nc(C(=O)N3CCCN(C(=O)N4CCC4)CC3)c1CC2
• InChI: InChI=1S/2C30H36N4O4S.C28H34N6O4S.C27H28N4O2S.C25H31N3O3S/c1-19(2)38-25-18-23-21(17-24(25)37-3)10-11-22-27(31-28(34(22)23)26-9-5-16-39-26)30(36)33-13-6-12-32(14-15-33)29(35)20-7-4-8-20;1-19(2)38-26-17-24-21(16-25(26)37-3)7-8-23-27(31-28(34(23)24)22-10-15-39-18-22)30(36)33-11-4-6-20(9-14-33)29(35)32-12-5-13-32;1-18(2)38-23-15-21-19(14-22(23)37-3)6-7-20-25(30-26(34(20)21)24-16-29-17-39-24)27(35)31-8-4-11-33(13-12-31)28(36)32-9-5-10-32;1-27(2,3)30(4)26(32)24-21-9-8-17-13-23(33-5)20(18-7-6-11-28-15-18)14-22(17)31(21)25(29-24)19-10-12-34-16-19;1-15(2)31-20-14-18-16(13-19(20)30-7)10-11-17-22(24(29)27(6)25(3,4)5)26-23(28(17)18)21-9-8-12-32-21/h5,9,16-20H,4,6-8,10-15H2,1-3H3;10,15-20H,4-9,11-14H2,1-3H3;14-18H,4-13H2,1-3H3;6-7,10-16H,8-9H2,1-5H3;8-9,12-15H,10-11H2,1-7H3
• InChIKey: KSTZKSCPKUSQIB-UHFFFAOYSA-N
• XLogP: 24.81
• TPSA: 363.67 Ų
• H-Bond Acceptors: 34
• Rotatable Bonds: 26
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2574.32
LogP ≤ 5	24.81
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	34

Frequently Asked Questions

What is the IUPAC name of [4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone?

The IUPAC name of [4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone (CID 159230028) is [4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone.

What is the SMILES notation for [4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone?

The canonical SMILES for [4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone is COc1cc2c(cc1-c1cccnc1)-n1c(-c3ccsc3)nc(C(=O)N(C)C(C)(C)C)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(-c3cccs3)nc(C(=O)N(C)C(C)(C)C)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(-c3cccs3)nc(C(=O)N3CCCN(C(=O)C4CCC4)CC3)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(-c3ccsc3)nc(C(=O)N3CCCC(C(=O)N4CCC4)CC3)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(-c3cncs3)nc(C(=O)N3CCCN(C(=O)N4CCC4)CC3)c1CC2.

What is the InChIKey of [4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone?

The InChIKey is KSTZKSCPKUSQIB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C30H36N4O4S.C28H34N6O4S.C27H28N4O2S.C25H31N3O3S/c1-19(2)38-25-18-23-21(17-24(25)37-3)10-11-22-27(31-28(34(22)23)26-9-5-16-39-26)30(36)33-13-6-12-32(14-15-33)29(35)20-7-4-8-20;1-19(2)38-26-17-24-21(16-25(26)37-3)7-8-23-27(31-28(34(23)24)22-10-15-39-18-22)30(36)33-11-4-6-20(9-14-33)29(35)32-12-5-13-32;1-18(2)38-23-15-21-19(14-22(23)37-3)6-7-20-25(30-26(34(20)21)24-16-29-17-39-24)27(35)31-8-4-11-33(13-12-31)28(36)32-9-5-10-32;1-27(2,3)30(4)26(32)24-21-9-8-17-13-23(33-5)20(18-7-6-11-28-15-18)14-22(17)31(21)25(29-24)19-10-12-34-16-19;1-15(2)31-20-14-18-16(13-19(20)30-7)10-11-17-22(24(29)27(6)25(3,4)5)26-23(28(17)18)21-9-8-12-32-21/h5,9,16-20H,4,6-8,10-15H2,1-3H3;10,15-20H,4-9,11-14H2,1-3H3;14-18H,4-13H2,1-3H3;6-7,10-16H,8-9H2,1-5H3;8-9,12-15H,10-11H2,1-7H3.

What are the key properties of [4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone?

[4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone has a molecular weight of 2574.32 g/mol, XLogP of 24.81, 26 rotatable bonds, 0 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for [4-(azetidine-1-carbonyl)-1,4-diazepan-1-yl]-[7-methoxy-8-propan-2-yloxy-1-(1,3-thiazol-5-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone;azetidin-1-yl-[1-(7-methoxy-8-propan-2-yloxy-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)azepan-4-yl]methanone;N-tert-butyl-7-methoxy-N-methyl-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;N-tert-butyl-7-methoxy-N-methyl-8-pyridin-3-yl-1-thiophen-3-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carboxamide;cyclobutyl-[4-(7-methoxy-8-propan-2-yloxy-1-thiophen-2-yl-4,5-dihydroimidazo[1,5-a]quinoline-3-carbonyl)-1,4-diazepan-1-yl]methanone is sourced from PubChem (CID 159230028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).