CS-0433937
(1R,2S,5S)-N-((S)-1-Amino-1-oxo-3-((S)-2-oxopyrrolidin-3-yl)propan-2-yl)-3-((S)-3,3-dimethyl-2-(2,2,2-trifluoroacetamido)butanoyl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide
Manufacturer: ChemScene
CAS Number: 2755812-81-6
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₃H₃₄F₃N₅O₅
Molecular Weight
517.54
Synonyms
None
SMILES
O=C([C@@H]1[C@]2([H])[C@@](CN1C([C@H](C(C)(C)C)NC(C(F)(F)F)=O)=O)([H])C(C)2C)N[C@H](C(N)=O)C[C@H](CCN3)C3=O
Tpsa
150.7
Logp
0.0589
H Acceptors
5
H Donors
4
Rotatable Bonds
7
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₃₄F₃N₅O₅
Molecular Weight: 517.54
Synonyms: None
SMILES: O=C([C@@H]1[C@]2([H])[C@@](CN1C([C@H](C(C)(C)C)NC(C(F)(F)F)=O)=O)([H])C(C)2C)N[C@H](C(N)=O)C[C@H](CCN3)C3=O
Tpsa: 150.7
Logp: 0.0589
H Acceptors: 5
H Donors: 4
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₃₄F₃N₅O₅
Molecular Weight:
517.54
Synonyms:
None
SMILES:
O=C([C@@H]1[C@]2([H])[C@@](CN1C([C@H](C(C)(C)C)NC(C(F)(F)F)=O)=O)([H])C(C)2C)N[C@H](C(N)=O)C[C@H](CCN3)C3=O
Tpsa:
150.7
Logp:
0.0589
H Acceptors:
5
H Donors:
4
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₆Cl₆N₆
Molecular Weight: 591.06
Synonyms: HATNA-Cl6
SMILES: ClC1=CC2=C(C=C1Cl)N=C(C3=C(C4=C5N=C6C=C(Cl)C(Cl)=CC6=N4)N=C7C=C(Cl)C(Cl)=CC7=N3)C5=N2
Tpsa: 77.34
Logp: 8.8962
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₆Cl₆N₆
Molecular Weight:
591.06
Synonyms:
HATNA-Cl6
SMILES:
ClC1=CC2=C(C=C1Cl)N=C(C3=C(C4=C5N=C6C=C(Cl)C(Cl)=CC6=N4)N=C7C=C(Cl)C(Cl)=CC7=N3)C5=N2
Tpsa:
77.34
Logp:
8.8962
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
0
Purity: 99%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₆H₇₂N₂O₂S₂
Molecular Weight: 749.21
Synonyms: 2,5-Di(2-C6C10)-3,6-di(thiophen-2-yl)-diketopyrrolopyrrole
SMILES: O=C1C(C2=C(N1CC(CCCCCCCC)CCCCCC)C3=CC=CS3)=C(C4=CC=CS4)N(CC(CCCCCCCC)CCCCCC)C2=O
Tpsa: 40.62
Logp: 14.2908
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 30
Purity:
99%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₆H₇₂N₂O₂S₂
Molecular Weight:
749.21
Synonyms:
2,5-Di(2-C6C10)-3,6-di(thiophen-2-yl)-diketopyrrolopyrrole
SMILES:
O=C1C(C2=C(N1CC(CCCCCCCC)CCCCCC)C3=CC=CS3)=C(C4=CC=CS4)N(CC(CCCCCCCC)CCCCCC)C2=O
Tpsa:
40.62
Logp:
14.2908
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
30
Purity: 95+%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅₁H₃₆N₂
Molecular Weight: 676.84
Synonyms: DPFL-CBP , 2,7-Bis(carbazol-9-yl)-9,9-ditolylfluorene
SMILES: CC(C=C1)=CC=C1C2(C3=CC=C(C)C=C3)C4=CC(N5C6=C(C7=C5C=CC=C7)C=CC=C6)=CC=C4C8=C2C=C(C=C8)N9C%10=C(C=CC=C%10)C%11=C9C=CC=C%11
Tpsa: 9.86
Logp: 12.8607
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 4
Purity:
95+%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₁H₃₆N₂
Molecular Weight:
676.84
Synonyms:
DPFL-CBP , 2,7-Bis(carbazol-9-yl)-9,9-ditolylfluorene
SMILES:
CC(C=C1)=CC=C1C2(C3=CC=C(C)C=C3)C4=CC(N5C6=C(C7=C5C=CC=C7)C=CC=C6)=CC=C4C8=C2C=C(C=C8)N9C%10=C(C=CC=C%10)C%11=C9C=CC=C%11
Tpsa:
9.86
Logp:
12.8607
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
4