5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one

C14H10N3OP — CID 71176384

IUPAC5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one
SMILESO=c1n(P)c2ccccc2c2nc3ccccc3n12
InChIInChI=1S/C14H10N3OP/c18-14-16-12-8-4-2-6-10(12)15-13(16)9-5-1-3-7-11(9)17(14)19/h1-8H,19H2
InChIKeyWTGXKBISPXWHIP-UHFFFAOYSA-N
MW267.23 g/mol
LogP2.44
Rot. Bonds

About 5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one

5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one (PubChem CID 71176384) has the molecular formula C14H10N3OP and a molecular weight of 267.23 g/mol. Its IUPAC name is 5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one.

Molecular Properties

Compound Name5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one
PubChem CID71176384
Molecular FormulaC14H10N3OP
Molecular Weight267.23 g/mol
Exact Mass267.06
IUPAC Name5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one
SMILESO=c1n(P)c2ccccc2c2nc3ccccc3n12
InChIInChI=1S/C14H10N3OP/c18-14-16-12-8-4-2-6-10(12)15-13(16)9-5-1-3-7-11(9)17(14)19/h1-8H,19H2
InChIKeyWTGXKBISPXWHIP-UHFFFAOYSA-N
XLogP2.44
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.23
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,9,17-triazaheptacyclo[15.10.1.02,10.03,8.011,16.018,23.024,28]octacosa-1(27),3,5,7,9,11,13,15,18,20,22,24(28),25-tridecaene
CID 164734138
25-phenyl-2,9,17-triazahexacyclo[15.8.0.02,10.03,8.011,16.019,24]pentacosa-1(25),3,5,7,9,11,13,15,19,21,23-undecaen-18-one
CID 165126176
5-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]benzimidazolo[1,2-c]quinazolin-6-one
CID 164776394
ethane;7,14,25,32-tetrazaundecacyclo[21.13.2.22,5.03,19.04,16.06,14.08,13.020,37.024,32.026,31.034,38]tetraconta-1(36),2,4,6,8,10,12,16,18,20(37),21,23(38),24,26,28,30,34,39-octadecaene-15,33-dione
CID 90702606
9-oxa-1,18-diazahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-2(10),3,5,7,11,13,15,17,19,21,23-undecaene
CID 129128192
5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]benzimidazolo[1,2-c]quinazolin-6-one
CID 164776379
15-amino-3,10-diazapentacyclo[10.7.1.02,10.04,9.016,20]icosa-1(19),2,4,6,8,12(20),13,15,17-nonaen-11-one
CID 3512510
17-hydroxy-3,10-diazapentacyclo[10.7.1.02,10.04,9.016,20]icosa-1(20),2,4,6,8,12,14,16,18-nonaen-11-one
CID 141341157
14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8(13),9,11,15,17,19-decaen-9-ol
CID 146639537
3,10-diazaheptacyclo[15.12.0.02,10.04,9.011,16.018,23.024,29]nonacosa-1(17),2,4,6,8,11,13,15,18,20,22,24,26,28-tetradecaene
CID 139436188
15,17-di(carbazol-9-yl)-3,10-diazapentacyclo[10.7.1.02,10.04,9.016,20]icosa-1(20),2,4,6,8,12,14,16,18-nonaen-11-one
CID 121248140
11-oxo-3,10-diazapentacyclo[10.7.1.02,10.04,9.016,20]icosa-1(20),2,4,6,8,12,14,16,18-nonaene-17-carbaldehyde
CID 88895903

Frequently Asked Questions

What is the IUPAC name of 5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one?
The IUPAC name of 5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one (CID 71176384) is 5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one.
What is the SMILES notation for 5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one?
The canonical SMILES for 5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one is O=c1n(P)c2ccccc2c2nc3ccccc3n12.
What is the InChIKey of 5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one?
The InChIKey is WTGXKBISPXWHIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N3OP/c18-14-16-12-8-4-2-6-10(12)15-13(16)9-5-1-3-7-11(9)17(14)19/h1-8H,19H2.
What are the key properties of 5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one?
5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one has a molecular weight of 267.23 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one is sourced from PubChem (CID 71176384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).