[email protected]
CAS 702675-74-9 N-[3-[[5-Iodo-4-[[3-[(2-thienylcarbonyl)amino]propyl]amino]-2-pyrimidinyl]amino]phenyl]-1-pyrrolidinecarboxamide molecular structure lightbox
CAS RN: 702675-74-9

N-[3-[[5-Iodo-4-[[3-[(2-thienylcarbonyl)amino]propyl]amino]-2-pyrimidinyl]amino]phenyl]-1-pyrrolidinecarboxamide

Product Availability

Choose a grade to view its available package options.

11 package records11 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250505 100mg In stock Shanghai Inquiry
Batchno.20260211 10mg In stock Shanghai Inquiry
Batchno.20250511 1mg In stock Shanghai Inquiry
Batchno.20260216 250mg In stock Shanghai Inquiry
Batchno.20250726 25mg In stock Shanghai Inquiry
Batchno.20250825 50mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260424 1ml In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251212 100mg In stock Inquiry
Batchno.20260420 10mg In stock Inquiry
Batchno.20250411 1mg In stock Inquiry
Batchno.20260203 50mg In stock Inquiry
  • Product code: SSC-180085
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: 0.25g
  • Available purity: ≥95%
  • 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 702675-74-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Beijing Inquiry

702675-74-9 / N-[3-[[5-iodo-4-[3-(thiophene-2-carbonylamino)propylamino]pyrimidin-2-yl]amino]phenyl]pyrrolidine-1-carboxamide

Standard CAS: 702675-74-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
702675-74-9
Multi CAS
Yes
Molecular Formula
C23H26In7O2S
Molecular Weight
591.500000
Exact Mass
591.091340
InChI
InChI=1S/C23H26IN7O2S/c24-18-15-27-22(30-20(18)25-9-5-10-26-21(32)19-8-4-13-34-19)28-16-6-3-7-17(14-16)29-23(33)31-11-1-2-12-31/h3-4,6-8,13-15H,1-2,5,9-12H2,(H,26,32)(H,29,33)(H2,25,27,28,30)
InChIKey
VAVXGGRQQJZYBL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
34
Aromatic heavy atom count
17
Fraction Csp3
0.3
Rotatable bonds
9
H-bond acceptors
7
H-bond donors
4
Molar refractivity
144.06
TPSA
111.28

LogP / Solubility

WLOGP
4.75
MLOGP
4.22
XLogP3
4.6
Consensus LogP
4.52
Log S (ESOL)
-6.27
Class (ESOL)
Insoluble
Log S (Ali)
-7.84
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.52
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.96

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

Customers Also Viewed

Get In Touch

Contact Us