(5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione

C89H81N15O12 — CID 158859761

About (5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione

(5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione (PubChem CID 158859761) has the molecular formula C89H81N15O12 and a molecular weight of 1552.72 g/mol. Its IUPAC name is (5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione.

Molecular Properties

• Compound Name: (5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione
• PubChem CID: 158859761
• Molecular Formula: C89H81N15O12
• Molecular Weight: 1552.72 g/mol
• Exact Mass: 1551.62
• IUPAC Name: (5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione
• SMILES: COc1ccc2c(c1)C(=O)N(C[C@@]1(c3ccc(-c4ccc5c(cnn5C(C)C)c4)cc3)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3ccc(-c4ccc5c(cnn5CC5CC5)c4)cc3)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3ccc(-c4ccc5nn(CC6CC6)cc5c4)cc3)NC(=O)NC1=O)C2
• InChI: InChI=1S/2C30H27N5O4.C29H27N5O4/c1-39-24-10-6-21-16-34(27(36)25(21)13-24)17-30(28(37)32-29(38)33-30)23-8-4-19(5-9-23)20-7-11-26-22(12-20)14-31-35(26)15-18-2-3-18;1-39-24-10-6-21-15-34(27(36)25(21)13-24)17-30(28(37)31-29(38)32-30)23-8-4-19(5-9-23)20-7-11-26-22(12-20)16-35(33-26)14-18-2-3-18;1-17(2)34-25-11-7-19(12-21(25)14-30-34)18-4-8-22(9-5-18)29(27(36)31-28(37)32-29)16-33-15-20-6-10-23(38-3)13-24(20)26(33)35/h4-14,18H,2-3,15-17H2,1H3,(H2,32,33,37,38);4-13,16,18H,2-3,14-15,17H2,1H3,(H2,31,32,37,38);4-14,17H,15-16H2,1-3H3,(H2,31,32,36,37)/t2*30-;29-/m000/s1
• InChIKey: JAMWUJOIFPXESG-OFIJSXTJSA-N
• XLogP: 11.61
• TPSA: 316.68 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 18
• Rotatable Bonds: 20
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1552.72
LogP ≤ 5	11.61
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione?

The IUPAC name of (5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione (CID 158859761) is (5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione.

What is the SMILES notation for (5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione?

The canonical SMILES for (5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione is COc1ccc2c(c1)C(=O)N(C[C@@]1(c3ccc(-c4ccc5c(cnn5C(C)C)c4)cc3)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3ccc(-c4ccc5c(cnn5CC5CC5)c4)cc3)NC(=O)NC1=O)C2.COc1ccc2c(c1)C(=O)N(C[C@@]1(c3ccc(-c4ccc5nn(CC6CC6)cc5c4)cc3)NC(=O)NC1=O)C2.

What is the InChIKey of (5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione?

The InChIKey is JAMWUJOIFPXESG-OFIJSXTJSA-N. The full InChI is InChI=1S/2C30H27N5O4.C29H27N5O4/c1-39-24-10-6-21-16-34(27(36)25(21)13-24)17-30(28(37)32-29(38)33-30)23-8-4-19(5-9-23)20-7-11-26-22(12-20)14-31-35(26)15-18-2-3-18;1-39-24-10-6-21-15-34(27(36)25(21)13-24)17-30(28(37)31-29(38)32-30)23-8-4-19(5-9-23)20-7-11-26-22(12-20)16-35(33-26)14-18-2-3-18;1-17(2)34-25-11-7-19(12-21(25)14-30-34)18-4-8-22(9-5-18)29(27(36)31-28(37)32-29)16-33-15-20-6-10-23(38-3)13-24(20)26(33)35/h4-14,18H,2-3,15-17H2,1H3,(H2,32,33,37,38);4-13,16,18H,2-3,14-15,17H2,1H3,(H2,31,32,37,38);4-14,17H,15-16H2,1-3H3,(H2,31,32,36,37)/t2*30-;29-/m000/s1.

What are the key properties of (5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione?

(5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione has a molecular weight of 1552.72 g/mol, XLogP of 11.61, 20 rotatable bonds, 6 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for (5R)-5-[4-[1-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[4-[2-(cyclopropylmethyl)indazol-5-yl]phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(1-propan-2-ylindazol-5-yl)phenyl]imidazolidine-2,4-dione is sourced from PubChem (CID 158859761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).