Procaine phosphateProduct ingredient for Procaine

Name
Procaine phosphate
Drug Entry
Procaine

A local anesthetic of the ester type that has a slow onset and a short duration of action. It is mainly used for infiltration anesthesia, peripheral nerve block, and spinal block. (From Martindale, The Extra Pharmacopoeia, 30th ed, p1016). Procaine has also been investigated as an oral entry inhibitor in treatment-experienced HIV patients 2.

Accession Number
DBSALT002215
Structure
Synonyms
Not Available
UNII
A18LHT9ZXJ
CAS Number
54812-66-7
Weight
Average: 334.309
Monoisotopic: 334.129373467
Chemical Formula
C13H23N2O6P
InChI Key
NPBISBZNYVWJOL-UHFFFAOYSA-N
InChI
InChI=1S/C13H20N2O2.H3O4P/c1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11;1-5(2,3)4/h5-8H,3-4,9-10,14H2,1-2H3;(H3,1,2,3,4)
IUPAC Name
2-(diethylamino)ethyl 4-aminobenzoate; phosphoric acid
SMILES
OP(O)(O)=O.CCN(CC)CCOC(=O)C1=CC=C(N)C=C1
ChemSpider
202785
Predicted Properties
PropertyValueSource
Water Solubility6.81 mg/mLALOGPS
logP2.1ALOGPS
logP1.88Chemaxon
logS-1.5ALOGPS
pKa (Strongest Basic)8.96Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area55.56 Å2Chemaxon
Rotatable Bond Count7Chemaxon
Refractivity70.3 m3·mol-1Chemaxon
Polarizability27.32 Å3Chemaxon
Number of Rings1Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon