N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide

C19H12ClN5O2 — CID 170732461

IUPACN-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide
SMILESO=C(Nn1c(-c2cccc(Cl)c2)nc2ccccc2c1=O)c1cccnn1
InChIInChI=1S/C19H12ClN5O2/c20-13-6-3-5-12(11-13)17-22-15-8-2-1-7-14(15)19(27)25(17)24-18(26)16-9-4-10-21-23-16/h1-11H,(H,24,26)
InChIKeyYWJVJBMFAKVHNR-UHFFFAOYSA-N
MW377.79 g/mol
LogP2.89
Rot. Bonds3

About N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide

N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide (PubChem CID 170732461) has the molecular formula C19H12ClN5O2 and a molecular weight of 377.79 g/mol. Its IUPAC name is N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide
PubChem CID170732461
Molecular FormulaC19H12ClN5O2
Molecular Weight377.79 g/mol
Exact Mass377.07
IUPAC NameN-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide
SMILESO=C(Nn1c(-c2cccc(Cl)c2)nc2ccccc2c1=O)c1cccnn1
InChIInChI=1S/C19H12ClN5O2/c20-13-6-3-5-12(11-13)17-22-15-8-2-1-7-14(15)19(27)25(17)24-18(26)16-9-4-10-21-23-16/h1-11H,(H,24,26)
InChIKeyYWJVJBMFAKVHNR-UHFFFAOYSA-N
XLogP2.89
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.79
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridine-2-carboxamide
CID 170732450
N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]acetamide
CID 170732444
N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]furan-2-carboxamide
CID 170732422
3-chloro-N-[2-(4-chlorophenyl)-4-oxoquinazolin-3-yl]benzamide
CID 23909571
N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]-4-(diethylamino)benzamide
CID 23791833
N-[2-(3-methylphenyl)-4-oxoquinazolin-3-yl]benzamide
CID 170732468
2-chloro-N-[2-(3-methoxyphenyl)-4-oxoquinazolin-3-yl]benzamide
CID 23994102
3-methyl-N-(4-oxo-2-pyridin-4-ylquinazolin-3-yl)benzamide
CID 23881942
N-(3-chlorophenyl)-2-[(4-oxo-2-phenylquinazolin-3-yl)amino]acetamide
CID 10386527
2-chloro-N-(4-oxo-2-phenylquinazolin-3-yl)acetamide
CID 24750157
N-[2-(4-fluorophenyl)-4-oxoquinazolin-3-yl]benzamide
CID 23932693
2-chloro-N-[4-oxo-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]pyridine-3-carboxamide
CID 6737770

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide?
The IUPAC name of N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide (CID 170732461) is N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide.
What is the SMILES notation for N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide?
The canonical SMILES for N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide is O=C(Nn1c(-c2cccc(Cl)c2)nc2ccccc2c1=O)c1cccnn1.
What is the InChIKey of N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide?
The InChIKey is YWJVJBMFAKVHNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClN5O2/c20-13-6-3-5-12(11-13)17-22-15-8-2-1-7-14(15)19(27)25(17)24-18(26)16-9-4-10-21-23-16/h1-11H,(H,24,26).
What are the key properties of N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide?
N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide has a molecular weight of 377.79 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]pyridazine-3-carboxamide is sourced from PubChem (CID 170732461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).