[email protected]
CAS 19817-91-5 UDP SODIUM SALT molecular structure lightbox
CAS RN: 19817-91-5

UDP SODIUM SALT

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251109 1g / 5g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS19817-91-5
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

19817-91-5 / trisodium;[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] phosphate

Standard CAS: 19817-91-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
19817-91-5
Multi CAS
No
Molecular Formula
C9H11N2Na3O12P2
Molecular Weight
470.110000
Exact Mass
469.948031
SMILES
C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)([O-])[O-])O)O.[Na+].[Na+].[Na+]
InChI
InChI=1S/C9H14N2O12P2.3Na/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18;;;/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18);;;/q;3*+1/p-3/t4-,6-,7-,8-;;;/m1.../s1
InChIKey
GFASEGWJDXDCKZ-LLWADOMFSA-K

Computed Properties

Structural Parameters

Heavy atom count
28
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
6
H-bond acceptors
13
H-bond donors
3
Molar refractivity
69.5
TPSA
226.33

LogP / Solubility

WLOGP
-13.5
MLOGP
-11.85
XLogP3
-13.5
Consensus LogP
-12.95
Log S (ESOL)
5.99
Class (ESOL)
Highly soluble
Log S (Ali)
6.33
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
7.77
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-15.17

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5

Customers Also Viewed

Get In Touch

Contact Us