tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane

C119H140BCl3N16O15 — CID 158637496

About tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane

tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane (PubChem CID 158637496) has the molecular formula C119H140BCl3N16O15 and a molecular weight of 2151.70 g/mol. Its IUPAC name is tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane.

Molecular Properties

• Compound Name: tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane
• PubChem CID: 158637496
• Molecular Formula: C119H140BCl3N16O15
• Molecular Weight: 2151.70 g/mol
• Exact Mass: 2148.98
• IUPAC Name: tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane
• SMILES: CCNC(=O)c1noc(-c2cc(C(C)C)c(C)cc2OCc2ccccc2)c1-c1cc2n(c1)CCN(C(=O)OC(C)(C)C)C2.CCNC(=O)c1noc(-c2cc(C(C)C)c(C)cc2OCc2ccccc2)c1-c1cc2n(c1)CCN(C)C2.CCNC(=O)c1noc(-c2cc(C(C)C)c(C)cc2OCc2ccccc2)c1-c1cc2n(c1)CCNC2.CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1cc2n(c1)CCN(C)C2.ClB(Cl)Cl
• InChI: InChI=1S/C35H42N4O5.C31H36N4O3.C30H34N4O3.C23H28N4O4.BCl3/c1-8-36-33(40)31-30(25-17-26-20-39(15-14-38(26)19-25)34(41)43-35(5,6)7)32(44-37-31)28-18-27(22(2)3)23(4)16-29(28)42-21-24-12-10-9-11-13-24;1-6-32-31(36)29-28(23-15-24-18-34(5)12-13-35(24)17-23)30(38-33-29)26-16-25(20(2)3)21(4)14-27(26)37-19-22-10-8-7-9-11-22;1-5-32-30(35)28-27(22-14-23-16-31-11-12-34(23)17-22)29(37-33-28)25-15-24(19(2)3)20(4)13-26(25)36-18-21-9-7-6-8-10-21;1-5-24-23(30)21-20(14-8-15-12-26(4)6-7-27(15)11-14)22(31-25-21)17-9-16(13(2)3)18(28)10-19(17)29;2-1(3)4/h9-13,16-19,22H,8,14-15,20-21H2,1-7H3,(H,36,40);7-11,14-17,20H,6,12-13,18-19H2,1-5H3,(H,32,36);6-10,13-15,17,19,31H,5,11-12,16,18H2,1-4H3,(H,32,35);8-11,13,28-29H,5-7,12H2,1-4H3,(H,24,30)
• InChIKey: HZYLKEDVTJDANE-UHFFFAOYSA-N
• XLogP: 24.24
• TPSA: 356.44 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 26
• Rotatable Bonds: 29
• Heavy Atoms: 154
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2151.70
LogP ≤ 5	24.24
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane?

The IUPAC name of tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane (CID 158637496) is tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane.

What is the SMILES notation for tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane?

The canonical SMILES for tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane is CCNC(=O)c1noc(-c2cc(C(C)C)c(C)cc2OCc2ccccc2)c1-c1cc2n(c1)CCN(C(=O)OC(C)(C)C)C2.CCNC(=O)c1noc(-c2cc(C(C)C)c(C)cc2OCc2ccccc2)c1-c1cc2n(c1)CCN(C)C2.CCNC(=O)c1noc(-c2cc(C(C)C)c(C)cc2OCc2ccccc2)c1-c1cc2n(c1)CCNC2.CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1cc2n(c1)CCN(C)C2.ClB(Cl)Cl.

What is the InChIKey of tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane?

The InChIKey is HZYLKEDVTJDANE-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H42N4O5.C31H36N4O3.C30H34N4O3.C23H28N4O4.BCl3/c1-8-36-33(40)31-30(25-17-26-20-39(15-14-38(26)19-25)34(41)43-35(5,6)7)32(44-37-31)28-18-27(22(2)3)23(4)16-29(28)42-21-24-12-10-9-11-13-24;1-6-32-31(36)29-28(23-15-24-18-34(5)12-13-35(24)17-23)30(38-33-29)26-16-25(20(2)3)21(4)14-27(26)37-19-22-10-8-7-9-11-22;1-5-32-30(35)28-27(22-14-23-16-31-11-12-34(23)17-22)29(37-33-28)25-15-24(19(2)3)20(4)13-26(25)36-18-21-9-7-6-8-10-21;1-5-24-23(30)21-20(14-8-15-12-26(4)6-7-27(15)11-14)22(31-25-21)17-9-16(13(2)3)18(28)10-19(17)29;2-1(3)4/h9-13,16-19,22H,8,14-15,20-21H2,1-7H3,(H,36,40);7-11,14-17,20H,6,12-13,18-19H2,1-5H3,(H,32,36);6-10,13-15,17,19,31H,5,11-12,16,18H2,1-4H3,(H,32,35);8-11,13,28-29H,5-7,12H2,1-4H3,(H,24,30);.

What are the key properties of tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane?

tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane has a molecular weight of 2151.70 g/mol, XLogP of 24.24, 29 rotatable bonds, 7 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl 7-[3-(ethylcarbamoyl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazol-4-yl]-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate;5-(2,4-dihydroxy-5-propan-2-ylphenyl)-N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;N-ethyl-4-(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-1,2-oxazole-3-carboxamide;N-ethyl-5-(4-methyl-2-phenylmethoxy-5-propan-2-ylphenyl)-4-(1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl)-1,2-oxazole-3-carboxamide;trichloroborane is sourced from PubChem (CID 158637496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).