[email protected]
CAS 1271930-15-4 cinacalcet iMpurity 8 molecular structure lightbox
CAS RN: 1271930-15-4

cinacalcet iMpurity 8

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250911 5mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1271930-15-4
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1271930-15-4 / N-[(1R)-1-naphthalen-1-ylethyl]-3-[3-(trifluoromethyl)phenyl]-N-[3-[3-(trifluoromethyl)phenyl]propyl]propan-1-amine

Standard CAS: 1271930-15-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1271930-15-4
Multi CAS
No
Molecular Formula
C32H31F6N
Molecular Weight
543.600000
Exact Mass
543.236069
SMILES
C[C@H](C1=CC=CC2=CC=CC=C21)N(CCCC3=CC(=CC=C3)C(F)(F)F)CCCC4=CC(=CC=C4)C(F)(F)F
InChI
InChI=1S/C32H31F6N/c1-23(29-18-6-14-26-13-2-3-17-30(26)29)39(19-7-11-24-9-4-15-27(21-24)31(33,34)35)20-8-12-25-10-5-16-28(22-25)32(36,37)38/h2-6,9-10,13-18,21-23H,7-8,11-12,19-20H2,1H3/t23-/m1/s1
InChIKey
BMWNEBVDXWCUKG-HSZRJFAPSA-N

Computed Properties

Structural Parameters

Heavy atom count
39
Aromatic heavy atom count
22
Fraction Csp3
0.31
Rotatable bonds
10
H-bond acceptors
1
Molar refractivity
143.47
TPSA
3.24

LogP / Solubility

WLOGP
9.51
MLOGP
8.41
XLogP3
9.8
Consensus LogP
9.24
Log S (ESOL)
-8.96
Class (ESOL)
Insoluble
Log S (Ali)
-10.88
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.28
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.71

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
5

Customers Also Viewed

Get In Touch

Contact Us