CS-0803073
(2S)-2-[[8-Tert-butoxycarbonyl-3-(2,4,5-trifluorophenyl)-5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepine-1-carbonyl]amino]-3,3-dimethyl-butanoic acid
Manufacturer: ChemScene
CAS Number: 1160161-73-8
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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
C₂₅H₃₁F₃N₄O₅
Molecular Weight
524.53
Synonyms
None
SMILES
CC(C)(C)OC(=O)N1CC2N(CCC1)C(=NC=2C(=O)N[C@H](C(O)=O)C(C)(C)C)C3=C(F)C=C(F)C(F)=C3
Tpsa
113.76
Logp
4.3373
H Acceptors
6
H Donors
2
Rotatable Bonds
4
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SAFETY INFORMATION
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: C₂₅H₃₁F₃N₄O₅
Molecular Weight: 524.53
Synonyms: None
SMILES: CC(C)(C)OC(=O)N1CC2N(CCC1)C(=NC=2C(=O)N[C@H](C(O)=O)C(C)(C)C)C3=C(F)C=C(F)C(F)=C3
Tpsa: 113.76
Logp: 4.3373
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₃₁F₃N₄O₅
Molecular Weight:
524.53
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N1CC2N(CCC1)C(=NC=2C(=O)N[C@H](C(O)=O)C(C)(C)C)C3=C(F)C=C(F)C(F)=C3
Tpsa:
113.76
Logp:
4.3373
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₃₃F₃N₄O₅
Molecular Weight: 538.56
Synonyms: None
SMILES: COC(=O)[C@@H](NC(=O)C1=C2N(CCCN(C(=O)OC(C)(C)C)C2)C(=N1)C3=C(F)C=C(F)C(F)=C3)C(C)(C)C
Tpsa: 102.76
Logp: 4.4257
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₃₃F₃N₄O₅
Molecular Weight:
538.56
Synonyms:
None
SMILES:
COC(=O)[C@@H](NC(=O)C1=C2N(CCCN(C(=O)OC(C)(C)C)C2)C(=N1)C3=C(F)C=C(F)C(F)=C3)C(C)(C)C
Tpsa:
102.76
Logp:
4.4257
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₃NO₅
Molecular Weight: 273.33
Synonyms: None
SMILES: CCOC(=O)[C@@H]1N(CCC[C@@H]1O)C(=O)OC(C)(C)C
Tpsa: 76.07
Logp: 1.3099
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₂₃NO₅
Molecular Weight:
273.33
Synonyms:
None
SMILES:
CCOC(=O)[C@@H]1N(CCC[C@@H]1O)C(=O)OC(C)(C)C
Tpsa:
76.07
Logp:
1.3099
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₃NO₅
Molecular Weight: 273.33
Synonyms: None
SMILES: CCOC(=O)[C@H]1N(CCC[C@H]1O)C(=O)OC(C)(C)C
Tpsa: 76.07
Logp: 1.3099
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₂₃NO₅
Molecular Weight:
273.33
Synonyms:
None
SMILES:
CCOC(=O)[C@H]1N(CCC[C@H]1O)C(=O)OC(C)(C)C
Tpsa:
76.07
Logp:
1.3099
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2