[email protected]
CAS 27503-81-7 2-Phenyl-5-benzimidazolesulfonic Acid molecular structure lightbox
CAS RN: 27503-81-7

2-Phenyl-5-benzimidazolesulfonic Acid

  • Product code: SSC-126932
GET A QUOTE
Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 27503-81-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shenzhen Inquiry

27503-81-7 / 2-phenyl-3H-benzimidazole-5-sulfonic acid

Standard CAS: 27503-81-7 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
27503-81-7
Multi CAS
Yes
Molecular Formula
C13H10N2O3S
Molecular Weight
274.300000
Exact Mass
274.041213
InChI
InChI=1S/C13H10N2O3S/c16-19(17,18)10-6-7-11-12(8-10)15-13(14-11)9-4-2-1-3-5-9/h1-8H,(H,14,15)(H,16,17,18)
InChIKey
UVCJGUGAGLDPAA-UHFFFAOYSA-N

Physical Properties

Melting Point
>300, decomposes at 410

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
15
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
71.34
TPSA
83.05

LogP / Solubility

WLOGP
2.48
MLOGP
2.19
XLogP3
2
Consensus LogP
2.22
Log S (ESOL)
-3.55
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.6
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.74
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.63

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us