(4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone

C110H133N25O9S5 — CID 158104858

About (4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone

(4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone (PubChem CID 158104858) has the molecular formula C110H133N25O9S5 and a molecular weight of 2109.77 g/mol. Its IUPAC name is (4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone.

Molecular Properties

• Compound Name: (4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone
• PubChem CID: 158104858
• Molecular Formula: C110H133N25O9S5
• Molecular Weight: 2109.77 g/mol
• Exact Mass: 2107.93
• IUPAC Name: (4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone
• SMILES: Cc1cnc(C(O)C2CCCN(c3ncnc4cc(N5CCOCC5)ccc34)C2)s1.Cc1cnc(CC2CCCN(c3ncnc4cc(N5CCOCC5)ccc34)C2)s1.Cc1csc(C(O)C2CCCN(c3ncnc4cc(N5CCOCC5)ccc34)C2)n1.Cc1nc(C(O)C2CCCN(c3ncnc4cc(N5CCOCC5)ccc34)C2)sc1C.O=C(c1nccs1)C1CCCN(c2ncnc3cc(N4CCOCC4)ccc23)C1
• InChI: InChI=1S/C23H29N5O2S.2C22H27N5O2S.C22H27N5OS.C21H23N5O2S/c1-15-16(2)31-23(26-15)21(29)17-4-3-7-28(13-17)22-19-6-5-18(12-20(19)24-14-25-22)27-8-10-30-11-9-27;1-15-13-30-22(25-15)20(28)16-3-2-6-27(12-16)21-18-5-4-17(11-19(18)23-14-24-21)26-7-9-29-10-8-26;1-15-12-23-22(30-15)20(28)16-3-2-6-27(13-16)21-18-5-4-17(11-19(18)24-14-25-21)26-7-9-29-10-8-26;1-16-13-23-21(29-16)11-17-3-2-6-27(14-17)22-19-5-4-18(12-20(19)24-15-25-22)26-7-9-28-10-8-26;27-19(21-22-5-11-29-21)15-2-1-6-26(13-15)20-17-4-3-16(12-18(17)23-14-24-20)25-7-9-28-10-8-25/h5-6,12,14,17,21,29H,3-4,7-11,13H2,1-2H3;4-5,11,13-14,16,20,28H,2-3,6-10,12H2,1H3;4-5,11-12,14,16,20,28H,2-3,6-10,13H2,1H3;4-5,12-13,15,17H,2-3,6-11,14H2,1H3;3-5,11-12,14-15H,1-2,6-10,13H2
• InChIKey: FPSBRMSPRIBCOA-UHFFFAOYSA-N
• XLogP: 16.57
• TPSA: 349.66 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 39
• Rotatable Bonds: 20
• Heavy Atoms: 149
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2109.77
LogP ≤ 5	16.57
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	39

Frequently Asked Questions

What is the IUPAC name of (4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone?

The IUPAC name of (4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone (CID 158104858) is (4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone.

What is the SMILES notation for (4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone?

The canonical SMILES for (4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone is Cc1cnc(C(O)C2CCCN(c3ncnc4cc(N5CCOCC5)ccc34)C2)s1.Cc1cnc(CC2CCCN(c3ncnc4cc(N5CCOCC5)ccc34)C2)s1.Cc1csc(C(O)C2CCCN(c3ncnc4cc(N5CCOCC5)ccc34)C2)n1.Cc1nc(C(O)C2CCCN(c3ncnc4cc(N5CCOCC5)ccc34)C2)sc1C.O=C(c1nccs1)C1CCCN(c2ncnc3cc(N4CCOCC4)ccc23)C1.

What is the InChIKey of (4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone?

The InChIKey is FPSBRMSPRIBCOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N5O2S.2C22H27N5O2S.C22H27N5OS.C21H23N5O2S/c1-15-16(2)31-23(26-15)21(29)17-4-3-7-28(13-17)22-19-6-5-18(12-20(19)24-14-25-22)27-8-10-30-11-9-27;1-15-13-30-22(25-15)20(28)16-3-2-6-27(12-16)21-18-5-4-17(11-19(18)23-14-24-21)26-7-9-29-10-8-26;1-15-12-23-22(30-15)20(28)16-3-2-6-27(13-16)21-18-5-4-17(11-19(18)24-14-25-21)26-7-9-29-10-8-26;1-16-13-23-21(29-16)11-17-3-2-6-27(14-17)22-19-5-4-18(12-20(19)24-15-25-22)26-7-9-28-10-8-26;27-19(21-22-5-11-29-21)15-2-1-6-26(13-15)20-17-4-3-16(12-18(17)23-14-24-20)25-7-9-28-10-8-25/h5-6,12,14,17,21,29H,3-4,7-11,13H2,1-2H3;4-5,11,13-14,16,20,28H,2-3,6-10,12H2,1H3;4-5,11-12,14,16,20,28H,2-3,6-10,13H2,1H3;4-5,12-13,15,17H,2-3,6-11,14H2,1H3;3-5,11-12,14-15H,1-2,6-10,13H2.

What are the key properties of (4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone?

(4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone has a molecular weight of 2109.77 g/mol, XLogP of 16.57, 20 rotatable bonds, 3 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for (4,5-dimethyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;4-[4-[3-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]quinazolin-7-yl]morpholine;(4-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;(5-methyl-1,3-thiazol-2-yl)-[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]methanol;[1-(7-morpholin-4-ylquinazolin-4-yl)piperidin-3-yl]-(1,3-thiazol-2-yl)methanone is sourced from PubChem (CID 158104858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).