CS-0311488
(3R,4S,5S)-4-((S)-2-((S)-2-(Dimethylamino)-3-methylbutanamido)-N,3-dimethylbutanamido)-3-methoxy-5-methylheptanoic acid hydrochloride
Manufacturer: ChemScene
CAS Number: 2247145-33-9
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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
C₂₂H₄₄ClN₃O₅
Molecular Weight
466.05
Synonyms
INDEX NAME NOT YET ASSIGNED
SMILES
CC[C@H](C)[C@@H]([C@@H](CC(O)=O)OC)N(C([C@H](C(C)C)NC([C@H](C(C)C)N(C)C)=O)=O)C.[H]Cl
Tpsa
99.18
Logp
2.498
H Acceptors
5
H Donors
2
Rotatable Bonds
13
Related Products
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: C₂₂H₄₄ClN₃O₅
Molecular Weight: 466.05
Synonyms: INDEX NAME NOT YET ASSIGNED
SMILES: CC[C@H](C)[C@@H]([C@@H](CC(O)=O)OC)N(C([C@H](C(C)C)NC([C@H](C(C)C)N(C)C)=O)=O)C.[H]Cl
Tpsa: 99.18
Logp: 2.498
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 13
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₄₄ClN₃O₅
Molecular Weight:
466.05
Synonyms:
INDEX NAME NOT YET ASSIGNED
SMILES:
CC[C@H](C)[C@@H]([C@@H](CC(O)=O)OC)N(C([C@H](C(C)C)NC([C@H](C(C)C)N(C)C)=O)=O)C.[H]Cl
Tpsa:
99.18
Logp:
2.498
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
13
Purity: 95%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₈ClN₃O₂
Molecular Weight: 261.66
Synonyms: None
SMILES: O=C1NC(/C(N1)=C/C2=CNC3=C2C=CC=C3Cl)=O
Tpsa: 73.99
Logp: 2.0016
H Acceptors: 2
H Donors: 3
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₈ClN₃O₂
Molecular Weight:
261.66
Synonyms:
None
SMILES:
O=C1NC(/C(N1)=C/C2=CNC3=C2C=CC=C3Cl)=O
Tpsa:
73.99
Logp:
2.0016
H Acceptors:
2
H Donors:
3
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD00148939
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₇H₅₄N₅O₈P
Molecular Weight: 847.93
Synonyms: None
SMILES: CC(C)N(C(C)C)P(OCCC#N)O[C@@H](C[C@@](N1C(N=C(C(C)=C1)NC(C2=CC=CC=C2)=O)=O)([H])O3)[C@H]3COC(C4=CC=C(C=C4)OC)(C5=CC=CC=C5)C6=CC=C(C=C6)OC
Tpsa: 146.4
Logp: 8.7786
H Acceptors: 12
H Donors: 1
Rotatable Bonds: 19
Purity:
98%
MDL No:
MFCD00148939
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₇H₅₄N₅O₈P
Molecular Weight:
847.93
Synonyms:
None
SMILES:
CC(C)N(C(C)C)P(OCCC#N)O[C@@H](C[C@@](N1C(N=C(C(C)=C1)NC(C2=CC=CC=C2)=O)=O)([H])O3)[C@H]3COC(C4=CC=C(C=C4)OC)(C5=CC=CC=C5)C6=CC=C(C=C6)OC
Tpsa:
146.4
Logp:
8.7786
H Acceptors:
12
H Donors:
1
Rotatable Bonds:
19
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₉NO₅
Molecular Weight: 293.32
Synonyms: 4-[(tert-butoxy)carbonyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-5-carboxylic acid
SMILES: O=C(N1CCOC2=CC=CC=C2C1C(O)=O)OC(C)(C)C
Tpsa: 76.07
Logp: 2.4418
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₉NO₅
Molecular Weight:
293.32
Synonyms:
4-[(tert-butoxy)carbonyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-5-carboxylic acid
SMILES:
O=C(N1CCOC2=CC=CC=C2C1C(O)=O)OC(C)(C)C
Tpsa:
76.07
Logp:
2.4418
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1