N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide

C24H26N4O3S — CID 163336042

About N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide

N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide (PubChem CID 163336042) has the molecular formula C24H26N4O3S and a molecular weight of 450.56 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide.

Molecular Properties

• Compound Name: N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide
• PubChem CID: 163336042
• Molecular Formula: C24H26N4O3S
• Molecular Weight: 450.56 g/mol
• Exact Mass: 450.17
• IUPAC Name: N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide
• SMILES: CCCC1C(=O)N=C2c3ccccc3N=C(SC(CC)C(=O)Nc3ccc(OC)cc3)N21
• InChI: InChI=1S/C24H26N4O3S/c1-4-8-19-22(29)27-21-17-9-6-7-10-18(17)26-24(28(19)21)32-20(5-2)23(30)25-15-11-13-16(31-3)14-12-15/h6-7,9-14,19-20H,4-5,8H2,1-3H3,(H,25,30)
• InChIKey: QEZMTKOWJJKKJS-UHFFFAOYSA-N
• XLogP: 4.60
• TPSA: 83.36 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	450.56
LogP ≤ 5	4.60
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide?

The IUPAC name of N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide (CID 163336042) is N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide.

What is the SMILES notation for N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide?

The canonical SMILES for N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide is CCCC1C(=O)N=C2c3ccccc3N=C(SC(CC)C(=O)Nc3ccc(OC)cc3)N21.

What is the InChIKey of N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide?

The InChIKey is QEZMTKOWJJKKJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O3S/c1-4-8-19-22(29)27-21-17-9-6-7-10-18(17)26-24(28(19)21)32-20(5-2)23(30)25-15-11-13-16(31-3)14-12-15/h6-7,9-14,19-20H,4-5,8H2,1-3H3,(H,25,30).

What are the key properties of N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide?

N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide has a molecular weight of 450.56 g/mol, XLogP of 4.60, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-methoxyphenyl)-2-[(2-oxo-3-propyl-3H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide is sourced from PubChem (CID 163336042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).