propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate

C164H172F6N24O25 — CID 157139112

About propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate

propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate (PubChem CID 157139112) has the molecular formula C164H172F6N24O25 and a molecular weight of 2993.31 g/mol. Its IUPAC name is propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate.

Molecular Properties

• Compound Name: propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate
• PubChem CID: 157139112
• Molecular Formula: C164H172F6N24O25
• Molecular Weight: 2993.31 g/mol
• Exact Mass: 2991.28
• IUPAC Name: propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate
• SMILES: CCNC(=O)C1C(C)c2c([nH]c3ncccc23)C(C(=O)OC(C)C)=CN1C(=O)c1ccc(F)c(C)c1.CCNC(=O)C1N(C(=O)c2ccc(F)c(C)c2)C=C(C(=O)OC(C)C)c2[nH]c3ncccc3c2C1(C)C.CCNC(=O)C1N(C(=O)c2ccc(F)c(C)c2)C=C(C(=O)OC(C)C)c2[nH]c3ncccc3c2C12CC2.Cc1cc(C(=O)N2C=C(C(=O)OC(C)C)c3[nH]c4ncccc4c3CC2C(=O)N2CCCCC2)ccc1F.Cc1cc(C(=O)N2C=C(C(=O)OC(C)C)c3[nH]c4ncccc4c3CC2C(=O)N2CCOCC2)ccc1F.Cc1cc(C(=O)N2C=C(C(=O)OC(C)C)c3[nH]c4ncccc4c3CC2C(N)=O)ccc1F
• InChI: InChI=1S/C29H31FN4O4.C28H29FN4O5.C28H29FN4O4.C28H31FN4O4.C27H29FN4O4.C24H23FN4O4/c1-17(2)38-29(37)22-16-34(27(35)19-9-10-23(30)18(3)14-19)24(28(36)33-12-5-4-6-13-33)15-21-20-8-7-11-31-26(20)32-25(21)22;1-16(2)38-28(36)21-15-33(26(34)18-6-7-22(29)17(3)13-18)23(27(35)32-9-11-37-12-10-32)14-20-19-5-4-8-30-25(19)31-24(20)21;1-5-30-25(34)23-28(10-11-28)21-18-7-6-12-31-24(18)32-22(21)19(27(36)37-15(2)3)14-33(23)26(35)17-8-9-20(29)16(4)13-17;1-7-30-25(34)23-28(5,6)21-18-9-8-12-31-24(18)32-22(21)19(27(36)37-15(2)3)14-33(23)26(35)17-10-11-20(29)16(4)13-17;1-6-29-25(33)23-16(5)21-18-8-7-11-30-24(18)31-22(21)19(27(35)36-14(2)3)13-32(23)26(34)17-9-10-20(28)15(4)12-17;1-12(2)33-24(32)17-11-29(23(31)14-6-7-18(25)13(3)9-14)19(21(26)30)10-16-15-5-4-8-27-22(15)28-20(16)17/h7-11,14,16-17,24H,4-6,12-13,15H2,1-3H3,(H,31,32);4-8,13,15-16,23H,9-12,14H2,1-3H3,(H,30,31);6-9,12-15,23H,5,10-11H2,1-4H3,(H,30,34)(H,31,32);8-15,23H,7H2,1-6H3,(H,30,34)(H,31,32);7-14,16,23H,6H2,1-5H3,(H,29,33)(H,30,31);4-9,11-12,19H,10H2,1-3H3,(H2,26,30)(H,27,28)
• InChIKey: AJZDNFWFAIMDQB-UHFFFAOYSA-N
• XLogP: 22.77
• TPSA: 631.98 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 31
• Rotatable Bonds: 27
• Heavy Atoms: 219
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2993.31
LogP ≤ 5	22.77
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate?

The IUPAC name of propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate (CID 157139112) is propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate.

What is the SMILES notation for propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate?

The canonical SMILES for propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate is CCNC(=O)C1C(C)c2c([nH]c3ncccc23)C(C(=O)OC(C)C)=CN1C(=O)c1ccc(F)c(C)c1.CCNC(=O)C1N(C(=O)c2ccc(F)c(C)c2)C=C(C(=O)OC(C)C)c2[nH]c3ncccc3c2C1(C)C.CCNC(=O)C1N(C(=O)c2ccc(F)c(C)c2)C=C(C(=O)OC(C)C)c2[nH]c3ncccc3c2C12CC2.Cc1cc(C(=O)N2C=C(C(=O)OC(C)C)c3[nH]c4ncccc4c3CC2C(=O)N2CCCCC2)ccc1F.Cc1cc(C(=O)N2C=C(C(=O)OC(C)C)c3[nH]c4ncccc4c3CC2C(=O)N2CCOCC2)ccc1F.Cc1cc(C(=O)N2C=C(C(=O)OC(C)C)c3[nH]c4ncccc4c3CC2C(N)=O)ccc1F.

What is the InChIKey of propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate?

The InChIKey is AJZDNFWFAIMDQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H31FN4O4.C28H29FN4O5.C28H29FN4O4.C28H31FN4O4.C27H29FN4O4.C24H23FN4O4/c1-17(2)38-29(37)22-16-34(27(35)19-9-10-23(30)18(3)14-19)24(28(36)33-12-5-4-6-13-33)15-21-20-8-7-11-31-26(20)32-25(21)22;1-16(2)38-28(36)21-15-33(26(34)18-6-7-22(29)17(3)13-18)23(27(35)32-9-11-37-12-10-32)14-20-19-5-4-8-30-25(19)31-24(20)21;1-5-30-25(34)23-28(10-11-28)21-18-7-6-12-31-24(18)32-22(21)19(27(36)37-15(2)3)14-33(23)26(35)17-8-9-20(29)16(4)13-17;1-7-30-25(34)23-28(5,6)21-18-9-8-12-31-24(18)32-22(21)19(27(36)37-15(2)3)14-33(23)26(35)17-10-11-20(29)16(4)13-17;1-6-29-25(33)23-16(5)21-18-8-7-11-30-24(18)31-22(21)19(27(35)36-14(2)3)13-32(23)26(34)17-9-10-20(28)15(4)12-17;1-12(2)33-24(32)17-11-29(23(31)14-6-7-18(25)13(3)9-14)19(21(26)30)10-16-15-5-4-8-27-22(15)28-20(16)17/h7-11,14,16-17,24H,4-6,12-13,15H2,1-3H3,(H,31,32);4-8,13,15-16,23H,9-12,14H2,1-3H3,(H,30,31);6-9,12-15,23H,5,10-11H2,1-4H3,(H,30,34)(H,31,32);8-15,23H,7H2,1-6H3,(H,30,34)(H,31,32);7-14,16,23H,6H2,1-5H3,(H,29,33)(H,30,31);4-9,11-12,19H,10H2,1-3H3,(H2,26,30)(H,27,28).

What are the key properties of propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate?

propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate has a molecular weight of 2993.31 g/mol, XLogP of 22.77, 27 rotatable bonds, 10 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for propan-2-yl 13-carbamoyl-12-(4-fluoro-3-methylbenzoyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14,14-dimethyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)-14-methyl-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 13-(ethylcarbamoyl)-12-(4-fluoro-3-methylbenzoyl)spiro[6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-14,1'-cyclopropane]-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(morpholine-4-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate;propan-2-yl 12-(4-fluoro-3-methylbenzoyl)-13-(piperidine-1-carbonyl)-6,8,12-triazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5,10-pentaene-10-carboxylate is sourced from PubChem (CID 157139112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).